data_52655 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 52655 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for CBP-TAZ4 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2024-10-24 _Entry.Accession_date 2024-10-24 _Entry.Last_release_date 2024-10-24 _Entry.Original_release_date 2024-10-24 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Lorenzo Bracaglia . . . 0000-0001-8197-9828 52655 2 Silvia Oliveti . . . 0009-0002-1528-0853 52655 3 Isabella Felli . C. . 0000-0001-7755-0885 52655 4 Roberta Pierattelli . . . 0000-0002-6018-9090 52655 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 52655 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 803 52655 '15N chemical shifts' 272 52655 '1H chemical shifts' 227 52655 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2026-02-03 . original BMRB . 52655 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 52655 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 40223218 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Decoding Order and Disorder in Proteins by NMR Spectroscopy ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full 'Journal of the American Chemical Society' _Citation.Journal_volume 147 _Citation.Journal_issue 16 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1520-5126 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 13146 _Citation.Page_last 13157 _Citation.Year 2025 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Lorenzo Bracaglia . . . . 52655 1 2 Silvia Oliveti . . . . 52655 1 3 Isabella Felli . C. . . 52655 1 4 Roberta Pierattelli . . . . 52655 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 52655 _Assembly.ID 1 _Assembly.Name CBP-TAZ4 _Assembly.BMRB_code . _Assembly.Number_of_components 4 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 3 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 33493 _Assembly.Enzyme_commission_number . _Assembly.Details 'The molecular system is formed by a single CBP-TAZ4 polypeptide chain that binds 3 zinc ions.' _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 TAZ4 1 $entity_1 . . yes native no no . . . 52655 1 2 'Zinc ions, 1' 2 $entity_ZN . . no native no no . . . 52655 1 3 'Zinc ions, 2' 2 $entity_ZN . . no native no no . . . 52655 1 4 'Zinc ions, 3' 2 $entity_ZN . . no native no no . . . 52655 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 52655 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MGSPQESRRLSIQRAIQSLV HAAQCRNANCSLPSCQKMKR VVQHTKGCKRKTNGGCPVCK QLIALAAYHAKHCQENKCPV PFCLNIKHKLRQQQIQHRLQ QAQLMRRRMATMNTRNVPQQ SLPSPTSAPPGTPTQQPSTP QTPQPPAQPQPSPVSMSPAG FPSVARTQPPTTVSTGKPTS QVPAPPPPAQPPPAAVEAAR QIEREAQQQQHLYRVNINNS MPPGRTGMGTPGSQMAPVSL NVPRPNQVSGPVMPSMPPGQ WQQAPLPQQQPMPGLPRPVI SMQAQAAVAGPRMPSVQQLE HHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; Residues 1-2 are not native. Residues 298-306 are a non-native histidine tag. The sequence 3-297 corresponds to the 1763-2057 human CREB Binding Protein (CBP) region. ; _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers 306 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'free and other bound' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation 'C15A, C23A, C66A, C67A' _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 33297 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 52655 1 2 . GLY . 52655 1 3 . SER . 52655 1 4 . PRO . 52655 1 5 . GLN . 52655 1 6 . GLU . 52655 1 7 . SER . 52655 1 8 . ARG . 52655 1 9 . ARG . 52655 1 10 . LEU . 52655 1 11 . SER . 52655 1 12 . ILE . 52655 1 13 . GLN . 52655 1 14 . ARG . 52655 1 15 . ALA . 52655 1 16 . ILE . 52655 1 17 . GLN . 52655 1 18 . SER . 52655 1 19 . LEU . 52655 1 20 . VAL . 52655 1 21 . HIS . 52655 1 22 . ALA . 52655 1 23 . ALA . 52655 1 24 . GLN . 52655 1 25 . CYS . 52655 1 26 . ARG . 52655 1 27 . ASN . 52655 1 28 . ALA . 52655 1 29 . ASN . 52655 1 30 . CYS . 52655 1 31 . SER . 52655 1 32 . LEU . 52655 1 33 . PRO . 52655 1 34 . SER . 52655 1 35 . CYS . 52655 1 36 . GLN . 52655 1 37 . LYS . 52655 1 38 . MET . 52655 1 39 . LYS . 52655 1 40 . ARG . 52655 1 41 . VAL . 52655 1 42 . VAL . 52655 1 43 . GLN . 52655 1 44 . HIS . 52655 1 45 . THR . 52655 1 46 . LYS . 52655 1 47 . GLY . 52655 1 48 . CYS . 52655 1 49 . LYS . 52655 1 50 . ARG . 52655 1 51 . LYS . 52655 1 52 . THR . 52655 1 53 . ASN . 52655 1 54 . GLY . 52655 1 55 . GLY . 52655 1 56 . CYS . 52655 1 57 . PRO . 52655 1 58 . VAL . 52655 1 59 . CYS . 52655 1 60 . LYS . 52655 1 61 . GLN . 52655 1 62 . LEU . 52655 1 63 . ILE . 52655 1 64 . ALA . 52655 1 65 . LEU . 52655 1 66 . ALA . 52655 1 67 . ALA . 52655 1 68 . TYR . 52655 1 69 . HIS . 52655 1 70 . ALA . 52655 1 71 . LYS . 52655 1 72 . HIS . 52655 1 73 . CYS . 52655 1 74 . GLN . 52655 1 75 . GLU . 52655 1 76 . ASN . 52655 1 77 . LYS . 52655 1 78 . CYS . 52655 1 79 . PRO . 52655 1 80 . VAL . 52655 1 81 . PRO . 52655 1 82 . PHE . 52655 1 83 . CYS . 52655 1 84 . LEU . 52655 1 85 . ASN . 52655 1 86 . ILE . 52655 1 87 . LYS . 52655 1 88 . HIS . 52655 1 89 . LYS . 52655 1 90 . LEU . 52655 1 91 . ARG . 52655 1 92 . GLN . 52655 1 93 . GLN . 52655 1 94 . GLN . 52655 1 95 . ILE . 52655 1 96 . GLN . 52655 1 97 . HIS . 52655 1 98 . ARG . 52655 1 99 . LEU . 52655 1 100 . GLN . 52655 1 101 . GLN . 52655 1 102 . ALA . 52655 1 103 . GLN . 52655 1 104 . LEU . 52655 1 105 . MET . 52655 1 106 . ARG . 52655 1 107 . ARG . 52655 1 108 . ARG . 52655 1 109 . MET . 52655 1 110 . ALA . 52655 1 111 . THR . 52655 1 112 . MET . 52655 1 113 . ASN . 52655 1 114 . THR . 52655 1 115 . ARG . 52655 1 116 . ASN . 52655 1 117 . VAL . 52655 1 118 . PRO . 52655 1 119 . GLN . 52655 1 120 . GLN . 52655 1 121 . SER . 52655 1 122 . LEU . 52655 1 123 . PRO . 52655 1 124 . SER . 52655 1 125 . PRO . 52655 1 126 . THR . 52655 1 127 . SER . 52655 1 128 . ALA . 52655 1 129 . PRO . 52655 1 130 . PRO . 52655 1 131 . GLY . 52655 1 132 . THR . 52655 1 133 . PRO . 52655 1 134 . THR . 52655 1 135 . GLN . 52655 1 136 . GLN . 52655 1 137 . PRO . 52655 1 138 . SER . 52655 1 139 . THR . 52655 1 140 . PRO . 52655 1 141 . GLN . 52655 1 142 . THR . 52655 1 143 . PRO . 52655 1 144 . GLN . 52655 1 145 . PRO . 52655 1 146 . PRO . 52655 1 147 . ALA . 52655 1 148 . GLN . 52655 1 149 . PRO . 52655 1 150 . GLN . 52655 1 151 . PRO . 52655 1 152 . SER . 52655 1 153 . PRO . 52655 1 154 . VAL . 52655 1 155 . SER . 52655 1 156 . MET . 52655 1 157 . SER . 52655 1 158 . PRO . 52655 1 159 . ALA . 52655 1 160 . GLY . 52655 1 161 . PHE . 52655 1 162 . PRO . 52655 1 163 . SER . 52655 1 164 . VAL . 52655 1 165 . ALA . 52655 1 166 . ARG . 52655 1 167 . THR . 52655 1 168 . GLN . 52655 1 169 . PRO . 52655 1 170 . PRO . 52655 1 171 . THR . 52655 1 172 . THR . 52655 1 173 . VAL . 52655 1 174 . SER . 52655 1 175 . THR . 52655 1 176 . GLY . 52655 1 177 . LYS . 52655 1 178 . PRO . 52655 1 179 . THR . 52655 1 180 . SER . 52655 1 181 . GLN . 52655 1 182 . VAL . 52655 1 183 . PRO . 52655 1 184 . ALA . 52655 1 185 . PRO . 52655 1 186 . PRO . 52655 1 187 . PRO . 52655 1 188 . PRO . 52655 1 189 . ALA . 52655 1 190 . GLN . 52655 1 191 . PRO . 52655 1 192 . PRO . 52655 1 193 . PRO . 52655 1 194 . ALA . 52655 1 195 . ALA . 52655 1 196 . VAL . 52655 1 197 . GLU . 52655 1 198 . ALA . 52655 1 199 . ALA . 52655 1 200 . ARG . 52655 1 201 . GLN . 52655 1 202 . ILE . 52655 1 203 . GLU . 52655 1 204 . ARG . 52655 1 205 . GLU . 52655 1 206 . ALA . 52655 1 207 . GLN . 52655 1 208 . GLN . 52655 1 209 . GLN . 52655 1 210 . GLN . 52655 1 211 . HIS . 52655 1 212 . LEU . 52655 1 213 . TYR . 52655 1 214 . ARG . 52655 1 215 . VAL . 52655 1 216 . ASN . 52655 1 217 . ILE . 52655 1 218 . ASN . 52655 1 219 . ASN . 52655 1 220 . SER . 52655 1 221 . MET . 52655 1 222 . PRO . 52655 1 223 . PRO . 52655 1 224 . GLY . 52655 1 225 . ARG . 52655 1 226 . THR . 52655 1 227 . GLY . 52655 1 228 . MET . 52655 1 229 . GLY . 52655 1 230 . THR . 52655 1 231 . PRO . 52655 1 232 . GLY . 52655 1 233 . SER . 52655 1 234 . GLN . 52655 1 235 . MET . 52655 1 236 . ALA . 52655 1 237 . PRO . 52655 1 238 . VAL . 52655 1 239 . SER . 52655 1 240 . LEU . 52655 1 241 . ASN . 52655 1 242 . VAL . 52655 1 243 . PRO . 52655 1 244 . ARG . 52655 1 245 . PRO . 52655 1 246 . ASN . 52655 1 247 . GLN . 52655 1 248 . VAL . 52655 1 249 . SER . 52655 1 250 . GLY . 52655 1 251 . PRO . 52655 1 252 . VAL . 52655 1 253 . MET . 52655 1 254 . PRO . 52655 1 255 . SER . 52655 1 256 . MET . 52655 1 257 . PRO . 52655 1 258 . PRO . 52655 1 259 . GLY . 52655 1 260 . GLN . 52655 1 261 . TRP . 52655 1 262 . GLN . 52655 1 263 . GLN . 52655 1 264 . ALA . 52655 1 265 . PRO . 52655 1 266 . LEU . 52655 1 267 . PRO . 52655 1 268 . GLN . 52655 1 269 . GLN . 52655 1 270 . GLN . 52655 1 271 . PRO . 52655 1 272 . MET . 52655 1 273 . PRO . 52655 1 274 . GLY . 52655 1 275 . LEU . 52655 1 276 . PRO . 52655 1 277 . ARG . 52655 1 278 . PRO . 52655 1 279 . VAL . 52655 1 280 . ILE . 52655 1 281 . SER . 52655 1 282 . MET . 52655 1 283 . GLN . 52655 1 284 . ALA . 52655 1 285 . GLN . 52655 1 286 . ALA . 52655 1 287 . ALA . 52655 1 288 . VAL . 52655 1 289 . ALA . 52655 1 290 . GLY . 52655 1 291 . PRO . 52655 1 292 . ARG . 52655 1 293 . MET . 52655 1 294 . PRO . 52655 1 295 . SER . 52655 1 296 . VAL . 52655 1 297 . GLN . 52655 1 298 . GLN . 52655 1 299 . LEU . 52655 1 300 . GLU . 52655 1 301 . HIS . 52655 1 302 . HIS . 52655 1 303 . HIS . 52655 1 304 . HIS . 52655 1 305 . HIS . 52655 1 306 . HIS . 52655 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 52655 1 . GLY 2 2 52655 1 . SER 3 3 52655 1 . PRO 4 4 52655 1 . GLN 5 5 52655 1 . GLU 6 6 52655 1 . SER 7 7 52655 1 . ARG 8 8 52655 1 . ARG 9 9 52655 1 . LEU 10 10 52655 1 . SER 11 11 52655 1 . ILE 12 12 52655 1 . GLN 13 13 52655 1 . ARG 14 14 52655 1 . ALA 15 15 52655 1 . ILE 16 16 52655 1 . GLN 17 17 52655 1 . SER 18 18 52655 1 . LEU 19 19 52655 1 . VAL 20 20 52655 1 . HIS 21 21 52655 1 . ALA 22 22 52655 1 . ALA 23 23 52655 1 . GLN 24 24 52655 1 . CYS 25 25 52655 1 . ARG 26 26 52655 1 . ASN 27 27 52655 1 . ALA 28 28 52655 1 . ASN 29 29 52655 1 . CYS 30 30 52655 1 . SER 31 31 52655 1 . LEU 32 32 52655 1 . PRO 33 33 52655 1 . SER 34 34 52655 1 . CYS 35 35 52655 1 . GLN 36 36 52655 1 . LYS 37 37 52655 1 . MET 38 38 52655 1 . LYS 39 39 52655 1 . ARG 40 40 52655 1 . VAL 41 41 52655 1 . VAL 42 42 52655 1 . GLN 43 43 52655 1 . HIS 44 44 52655 1 . THR 45 45 52655 1 . LYS 46 46 52655 1 . GLY 47 47 52655 1 . CYS 48 48 52655 1 . LYS 49 49 52655 1 . ARG 50 50 52655 1 . LYS 51 51 52655 1 . THR 52 52 52655 1 . ASN 53 53 52655 1 . GLY 54 54 52655 1 . GLY 55 55 52655 1 . CYS 56 56 52655 1 . PRO 57 57 52655 1 . VAL 58 58 52655 1 . CYS 59 59 52655 1 . LYS 60 60 52655 1 . GLN 61 61 52655 1 . LEU 62 62 52655 1 . ILE 63 63 52655 1 . ALA 64 64 52655 1 . LEU 65 65 52655 1 . ALA 66 66 52655 1 . ALA 67 67 52655 1 . TYR 68 68 52655 1 . HIS 69 69 52655 1 . ALA 70 70 52655 1 . LYS 71 71 52655 1 . HIS 72 72 52655 1 . CYS 73 73 52655 1 . GLN 74 74 52655 1 . GLU 75 75 52655 1 . ASN 76 76 52655 1 . LYS 77 77 52655 1 . CYS 78 78 52655 1 . PRO 79 79 52655 1 . VAL 80 80 52655 1 . PRO 81 81 52655 1 . PHE 82 82 52655 1 . CYS 83 83 52655 1 . LEU 84 84 52655 1 . ASN 85 85 52655 1 . ILE 86 86 52655 1 . LYS 87 87 52655 1 . HIS 88 88 52655 1 . LYS 89 89 52655 1 . LEU 90 90 52655 1 . ARG 91 91 52655 1 . GLN 92 92 52655 1 . GLN 93 93 52655 1 . GLN 94 94 52655 1 . ILE 95 95 52655 1 . GLN 96 96 52655 1 . HIS 97 97 52655 1 . ARG 98 98 52655 1 . LEU 99 99 52655 1 . GLN 100 100 52655 1 . GLN 101 101 52655 1 . ALA 102 102 52655 1 . GLN 103 103 52655 1 . LEU 104 104 52655 1 . MET 105 105 52655 1 . ARG 106 106 52655 1 . ARG 107 107 52655 1 . ARG 108 108 52655 1 . MET 109 109 52655 1 . ALA 110 110 52655 1 . THR 111 111 52655 1 . MET 112 112 52655 1 . ASN 113 113 52655 1 . THR 114 114 52655 1 . ARG 115 115 52655 1 . ASN 116 116 52655 1 . VAL 117 117 52655 1 . PRO 118 118 52655 1 . GLN 119 119 52655 1 . GLN 120 120 52655 1 . SER 121 121 52655 1 . LEU 122 122 52655 1 . PRO 123 123 52655 1 . SER 124 124 52655 1 . PRO 125 125 52655 1 . THR 126 126 52655 1 . SER 127 127 52655 1 . ALA 128 128 52655 1 . PRO 129 129 52655 1 . PRO 130 130 52655 1 . GLY 131 131 52655 1 . THR 132 132 52655 1 . PRO 133 133 52655 1 . THR 134 134 52655 1 . GLN 135 135 52655 1 . GLN 136 136 52655 1 . PRO 137 137 52655 1 . SER 138 138 52655 1 . THR 139 139 52655 1 . PRO 140 140 52655 1 . GLN 141 141 52655 1 . THR 142 142 52655 1 . PRO 143 143 52655 1 . GLN 144 144 52655 1 . PRO 145 145 52655 1 . PRO 146 146 52655 1 . ALA 147 147 52655 1 . GLN 148 148 52655 1 . PRO 149 149 52655 1 . GLN 150 150 52655 1 . PRO 151 151 52655 1 . SER 152 152 52655 1 . PRO 153 153 52655 1 . VAL 154 154 52655 1 . SER 155 155 52655 1 . MET 156 156 52655 1 . SER 157 157 52655 1 . PRO 158 158 52655 1 . ALA 159 159 52655 1 . GLY 160 160 52655 1 . PHE 161 161 52655 1 . PRO 162 162 52655 1 . SER 163 163 52655 1 . VAL 164 164 52655 1 . ALA 165 165 52655 1 . ARG 166 166 52655 1 . THR 167 167 52655 1 . GLN 168 168 52655 1 . PRO 169 169 52655 1 . PRO 170 170 52655 1 . THR 171 171 52655 1 . THR 172 172 52655 1 . VAL 173 173 52655 1 . SER 174 174 52655 1 . THR 175 175 52655 1 . GLY 176 176 52655 1 . LYS 177 177 52655 1 . PRO 178 178 52655 1 . THR 179 179 52655 1 . SER 180 180 52655 1 . GLN 181 181 52655 1 . VAL 182 182 52655 1 . PRO 183 183 52655 1 . ALA 184 184 52655 1 . PRO 185 185 52655 1 . PRO 186 186 52655 1 . PRO 187 187 52655 1 . PRO 188 188 52655 1 . ALA 189 189 52655 1 . GLN 190 190 52655 1 . PRO 191 191 52655 1 . PRO 192 192 52655 1 . PRO 193 193 52655 1 . ALA 194 194 52655 1 . ALA 195 195 52655 1 . VAL 196 196 52655 1 . GLU 197 197 52655 1 . ALA 198 198 52655 1 . ALA 199 199 52655 1 . ARG 200 200 52655 1 . GLN 201 201 52655 1 . ILE 202 202 52655 1 . GLU 203 203 52655 1 . ARG 204 204 52655 1 . GLU 205 205 52655 1 . ALA 206 206 52655 1 . GLN 207 207 52655 1 . GLN 208 208 52655 1 . GLN 209 209 52655 1 . GLN 210 210 52655 1 . HIS 211 211 52655 1 . LEU 212 212 52655 1 . TYR 213 213 52655 1 . ARG 214 214 52655 1 . VAL 215 215 52655 1 . ASN 216 216 52655 1 . ILE 217 217 52655 1 . ASN 218 218 52655 1 . ASN 219 219 52655 1 . SER 220 220 52655 1 . MET 221 221 52655 1 . PRO 222 222 52655 1 . PRO 223 223 52655 1 . GLY 224 224 52655 1 . ARG 225 225 52655 1 . THR 226 226 52655 1 . GLY 227 227 52655 1 . MET 228 228 52655 1 . GLY 229 229 52655 1 . THR 230 230 52655 1 . PRO 231 231 52655 1 . GLY 232 232 52655 1 . SER 233 233 52655 1 . GLN 234 234 52655 1 . MET 235 235 52655 1 . ALA 236 236 52655 1 . PRO 237 237 52655 1 . VAL 238 238 52655 1 . SER 239 239 52655 1 . LEU 240 240 52655 1 . ASN 241 241 52655 1 . VAL 242 242 52655 1 . PRO 243 243 52655 1 . ARG 244 244 52655 1 . PRO 245 245 52655 1 . ASN 246 246 52655 1 . GLN 247 247 52655 1 . VAL 248 248 52655 1 . SER 249 249 52655 1 . GLY 250 250 52655 1 . PRO 251 251 52655 1 . VAL 252 252 52655 1 . MET 253 253 52655 1 . PRO 254 254 52655 1 . SER 255 255 52655 1 . MET 256 256 52655 1 . PRO 257 257 52655 1 . PRO 258 258 52655 1 . GLY 259 259 52655 1 . GLN 260 260 52655 1 . TRP 261 261 52655 1 . GLN 262 262 52655 1 . GLN 263 263 52655 1 . ALA 264 264 52655 1 . PRO 265 265 52655 1 . LEU 266 266 52655 1 . PRO 267 267 52655 1 . GLN 268 268 52655 1 . GLN 269 269 52655 1 . GLN 270 270 52655 1 . PRO 271 271 52655 1 . MET 272 272 52655 1 . PRO 273 273 52655 1 . GLY 274 274 52655 1 . LEU 275 275 52655 1 . PRO 276 276 52655 1 . ARG 277 277 52655 1 . PRO 278 278 52655 1 . VAL 279 279 52655 1 . ILE 280 280 52655 1 . SER 281 281 52655 1 . MET 282 282 52655 1 . GLN 283 283 52655 1 . ALA 284 284 52655 1 . GLN 285 285 52655 1 . ALA 286 286 52655 1 . ALA 287 287 52655 1 . VAL 288 288 52655 1 . ALA 289 289 52655 1 . GLY 290 290 52655 1 . PRO 291 291 52655 1 . ARG 292 292 52655 1 . MET 293 293 52655 1 . PRO 294 294 52655 1 . SER 295 295 52655 1 . VAL 296 296 52655 1 . GLN 297 297 52655 1 . GLN 298 298 52655 1 . LEU 299 299 52655 1 . GLU 300 300 52655 1 . HIS 301 301 52655 1 . HIS 302 302 52655 1 . HIS 303 303 52655 1 . HIS 304 304 52655 1 . HIS 305 305 52655 1 . HIS 306 306 52655 1 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID 52655 _Entity.ID 2 _Entity.BMRB_code ZN _Entity.Name entity_ZN _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 65.409 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'ZINC ION' BMRB 52655 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'ZINC ION' BMRB 52655 2 ZN 'Three letter code' 52655 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 ZN $chem_comp_ZN 52655 2 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 52655 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 52655 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 52655 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . plasmid . . pET28a . . . 52655 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 52655 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2020-07-10 _Chem_comp.Modified_date 2020-07-10 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Zn/q+2 _Chem_comp.Mon_nstd_flag no _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 52655 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 52655 ZN [Zn++] SMILES CACTVS 3.341 52655 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 52655 ZN [Zn+2] SMILES ACDLabs 10.04 52655 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 52655 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 52655 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 52655 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 52655 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN ZN ZN ZN . ZN . . N 2 . . . 0 N N . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 52655 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 52655 _Sample.ID 1 _Sample.Name 'Double-labelled TAZ4' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CBP-TAZ4 '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 250 . . uM . . . . 52655 1 2 'sodium acetate' 'natural abundance' . . . . . . 25 . . mM . . . . 52655 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 52655 1 4 TCEP 'natural abundance' . . . . . . 2 . . mM . . . . 52655 1 5 'zinc chloride' 'natural abundance' . . . . . . 0.1 . . mM . . . . 52655 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 52655 _Sample.ID 2 _Sample.Name '15N-labelled TAZ4' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CBP-TAZ4 '[U-100% 15N]' . . 1 $entity_1 . . 300 . . uM . . . . 52655 2 2 'sodium acetate' 'natural abundance' . . . . . . 25 . . mM . . . . 52655 2 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 52655 2 4 TCEP 'natural abundance' . . . . . . 2 . . mM . . . . 52655 2 5 'zinc chloride' 'natural abundance' . . . . . . 0.1 . . mM . . . . 52655 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 52655 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'Assignment conditions' _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 5.5 . pH 52655 1 temperature 298 . K 52655 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 52655 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 52655 1 processing . 52655 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 52655 _Software.ID 2 _Software.Type . _Software.Name NEASY _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 52655 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 52655 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker 1200' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 1200 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 52655 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 'Bruker 900' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 52655 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name 'Bruker 700' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruke _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 52655 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D CBCANH' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 52655 1 2 '3D CBCA(CO)NH' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 52655 1 3 '3D CBCACONH' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52655 1 4 '3D HNCO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 52655 1 5 '3D HN(CA)CO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 52655 1 6 '3D IR HNCO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 52655 1 7 '3D IR HNCA' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 52655 1 8 '2D CCCO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 52655 1 9 '2D CON' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 52655 1 10 '2D CBCACO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 52655 1 11 '3D (H)N(CA)NNH' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52655 1 12 '3D (H)N(COCA)NNH' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52655 1 13 '2D 1H-15N HSQC' no no no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . '2J HN on histidine side chains' 52655 1 14 '2D (HB)CB(CGCD)HD' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 52655 1 15 '2D 1H-13C TROSY' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 52655 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 52655 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'Reference details' _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 52655 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.0 . . . . . 52655 1 N 15 na nitrogen . . . . ppm 0 na direct 1.0 . . . . . 52655 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 52655 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'TAZ4 assignment' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.02 _Assigned_chem_shift_list.Chem_shift_15N_err 0.04 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D CBCANH' . . . 52655 1 2 '3D CBCA(CO)NH' . . . 52655 1 3 '3D CBCACONH' . . . 52655 1 4 '3D HNCO' . . . 52655 1 5 '3D HN(CA)CO' . . . 52655 1 6 '3D IR HNCO' . . . 52655 1 7 '3D IR HNCA' . . . 52655 1 8 '2D CCCO' . . . 52655 1 9 '2D CON' . . . 52655 1 10 '2D CBCACO' . . . 52655 1 11 '3D (H)N(CA)NNH' . . . 52655 1 12 '3D (H)N(COCA)NNH' . . . 52655 1 13 '2D 1H-15N HSQC' . . . 52655 1 14 '2D (HB)CB(CGCD)HD' . . . 52655 1 15 '2D 1H-13C TROSY' . . . 52655 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $software_2 . . 52655 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 GLY CA C 13 43.12 0.02 . . . . . . . 2 GLY CA . 52655 1 2 . 1 . 1 3 3 SER H H 1 8.73 0.01 . . . . . . . 3 SER HN . 52655 1 3 . 1 . 1 3 3 SER C C 13 173.19 0.02 . . . . . . . 3 SER C . 52655 1 4 . 1 . 1 3 3 SER CA C 13 56.57 0.02 . . . . . . . 3 SER CA . 52655 1 5 . 1 . 1 3 3 SER CB C 13 63.15 0.02 . . . . . . . 3 SER CB . 52655 1 6 . 1 . 1 3 3 SER N N 15 116.98 0.04 . . . . . . . 3 SER N . 52655 1 7 . 1 . 1 4 4 PRO C C 13 177.93 0.02 . . . . . . . 4 PRO C . 52655 1 8 . 1 . 1 4 4 PRO CA C 13 64.09 0.02 . . . . . . . 4 PRO CA . 52655 1 9 . 1 . 1 4 4 PRO CB C 13 31.75 0.02 . . . . . . . 4 PRO CB . 52655 1 10 . 1 . 1 5 5 GLN H H 1 8.48 0.01 . . . . . . . 5 GLN HN . 52655 1 11 . 1 . 1 5 5 GLN C C 13 177.20 0.02 . . . . . . . 5 GLN C . 52655 1 12 . 1 . 1 5 5 GLN CA C 13 57.3 0.02 . . . . . . . 5 GLN CA . 52655 1 13 . 1 . 1 5 5 GLN CB C 13 28.53 0.02 . . . . . . . 5 GLN CB . 52655 1 14 . 1 . 1 5 5 GLN N N 15 119.02 0.04 . . . . . . . 5 GLN N . 52655 1 15 . 1 . 1 6 6 GLU H H 1 8.22 0.01 . . . . . . . 6 GLU HN . 52655 1 16 . 1 . 1 6 6 GLU C C 13 177.47 0.02 . . . . . . . 6 GLU C . 52655 1 17 . 1 . 1 6 6 GLU CA C 13 57.68 0.02 . . . . . . . 6 GLU CA . 52655 1 18 . 1 . 1 6 6 GLU CB C 13 29.77 0.02 . . . . . . . 6 GLU CB . 52655 1 19 . 1 . 1 6 6 GLU N N 15 122.08 0.04 . . . . . . . 6 GLU N . 52655 1 20 . 1 . 1 7 7 SER H H 1 8.32 0.01 . . . . . . . 7 SER HN . 52655 1 21 . 1 . 1 7 7 SER C C 13 176.05 0.02 . . . . . . . 7 SER C . 52655 1 22 . 1 . 1 7 7 SER CA C 13 59.89 0.02 . . . . . . . 7 SER CA . 52655 1 23 . 1 . 1 7 7 SER CB C 13 63.04 0.02 . . . . . . . 7 SER CB . 52655 1 24 . 1 . 1 7 7 SER N N 15 116.30 0.04 . . . . . . . 7 SER N . 52655 1 25 . 1 . 1 8 8 ARG H H 1 8.21 0.01 . . . . . . . 8 ARG HN . 52655 1 26 . 1 . 1 8 8 ARG C C 13 177.55 0.02 . . . . . . . 8 ARG C . 52655 1 27 . 1 . 1 8 8 ARG CA C 13 58.08 0.02 . . . . . . . 8 ARG CA . 52655 1 28 . 1 . 1 8 8 ARG CB C 13 30.02 0.02 . . . . . . . 8 ARG CB . 52655 1 29 . 1 . 1 8 8 ARG N N 15 122.71 0.04 . . . . . . . 8 ARG N . 52655 1 30 . 1 . 1 9 9 ARG H H 1 7.99 0.01 . . . . . . . 9 ARG HN . 52655 1 31 . 1 . 1 9 9 ARG C C 13 178.09 0.02 . . . . . . . 9 ARG C . 52655 1 32 . 1 . 1 9 9 ARG CA C 13 58.59 0.02 . . . . . . . 9 ARG CA . 52655 1 33 . 1 . 1 9 9 ARG CB C 13 30.07 0.02 . . . . . . . 9 ARG CB . 52655 1 34 . 1 . 1 9 9 ARG N N 15 120.17 0.04 . . . . . . . 9 ARG N . 52655 1 35 . 1 . 1 10 10 LEU H H 1 8.15 0.01 . . . . . . . 10 LEU HN . 52655 1 36 . 1 . 1 10 10 LEU C C 13 178.75 0.02 . . . . . . . 10 LEU C . 52655 1 37 . 1 . 1 10 10 LEU CA C 13 57.11 0.02 . . . . . . . 10 LEU CA . 52655 1 38 . 1 . 1 10 10 LEU CB C 13 41.53 0.02 . . . . . . . 10 LEU CB . 52655 1 39 . 1 . 1 10 10 LEU N N 15 120.77 0.04 . . . . . . . 10 LEU N . 52655 1 40 . 1 . 1 11 11 SER H H 1 8.11 0.01 . . . . . . . 11 SER HN . 52655 1 41 . 1 . 1 11 11 SER C C 13 177.29 0.02 . . . . . . . 11 SER C . 52655 1 42 . 1 . 1 11 11 SER CA C 13 60.98 0.02 . . . . . . . 11 SER CA . 52655 1 43 . 1 . 1 11 11 SER CB C 13 62.55 0.02 . . . . . . . 11 SER CB . 52655 1 44 . 1 . 1 11 11 SER N N 15 115.81 0.04 . . . . . . . 11 SER N . 52655 1 45 . 1 . 1 12 12 ILE H H 1 8.07 0.01 . . . . . . . 12 ILE HN . 52655 1 46 . 1 . 1 12 12 ILE C C 13 177.13 0.02 . . . . . . . 12 ILE C . 52655 1 47 . 1 . 1 12 12 ILE CA C 13 64.19 0.02 . . . . . . . 12 ILE CA . 52655 1 48 . 1 . 1 12 12 ILE CB C 13 37.69 0.02 . . . . . . . 12 ILE CB . 52655 1 49 . 1 . 1 12 12 ILE N N 15 123.93 0.04 . . . . . . . 12 ILE N . 52655 1 50 . 1 . 1 13 13 GLN H H 1 8.04 0.01 . . . . . . . 13 GLN HN . 52655 1 51 . 1 . 1 13 13 GLN C C 13 179.11 0.02 . . . . . . . 13 GLN C . 52655 1 52 . 1 . 1 13 13 GLN CA C 13 59.29 0.02 . . . . . . . 13 GLN CA . 52655 1 53 . 1 . 1 13 13 GLN CB C 13 28.11 0.02 . . . . . . . 13 GLN CB . 52655 1 54 . 1 . 1 13 13 GLN N N 15 119.26 0.04 . . . . . . . 13 GLN N . 52655 1 55 . 1 . 1 14 14 ARG H H 1 8.2 0.01 . . . . . . . 14 ARG HN . 52655 1 56 . 1 . 1 14 14 ARG C C 13 178.96 0.02 . . . . . . . 14 ARG C . 52655 1 57 . 1 . 1 14 14 ARG CA C 13 59.00 0.02 . . . . . . . 14 ARG CA . 52655 1 58 . 1 . 1 14 14 ARG CB C 13 29.91 0.02 . . . . . . . 14 ARG CB . 52655 1 59 . 1 . 1 14 14 ARG N N 15 118.81 0.04 . . . . . . . 14 ARG N . 52655 1 60 . 1 . 1 15 15 ALA H H 1 7.97 0.01 . . . . . . . 15 ALA HN . 52655 1 61 . 1 . 1 15 15 ALA C C 13 180.49 0.02 . . . . . . . 15 ALA C . 52655 1 62 . 1 . 1 15 15 ALA CA C 13 55.21 0.02 . . . . . . . 15 ALA CA . 52655 1 63 . 1 . 1 15 15 ALA CB C 13 18.54 0.02 . . . . . . . 15 ALA CB . 52655 1 64 . 1 . 1 15 15 ALA N N 15 124.16 0.04 . . . . . . . 15 ALA N . 52655 1 65 . 1 . 1 16 16 ILE H H 1 8.67 0.01 . . . . . . . 16 ILE HN . 52655 1 66 . 1 . 1 16 16 ILE C C 13 177.65 0.02 . . . . . . . 16 ILE C . 52655 1 67 . 1 . 1 16 16 ILE CA C 13 65.20 0.02 . . . . . . . 16 ILE CA . 52655 1 68 . 1 . 1 16 16 ILE CB C 13 37.45 0.02 . . . . . . . 16 ILE CB . 52655 1 69 . 1 . 1 16 16 ILE N N 15 118.67 0.04 . . . . . . . 16 ILE N . 52655 1 70 . 1 . 1 17 17 GLN H H 1 8.11 0.01 . . . . . . . 17 GLN HN . 52655 1 71 . 1 . 1 17 17 GLN C C 13 179.53 0.02 . . . . . . . 17 GLN C . 52655 1 72 . 1 . 1 17 17 GLN CA C 13 59.21 0.02 . . . . . . . 17 GLN CA . 52655 1 73 . 1 . 1 17 17 GLN CB C 13 27.84 0.02 . . . . . . . 17 GLN CB . 52655 1 74 . 1 . 1 17 17 GLN N N 15 118.95 0.04 . . . . . . . 17 GLN N . 52655 1 75 . 1 . 1 18 18 SER H H 1 8.13 0.01 . . . . . . . 18 SER HN . 52655 1 76 . 1 . 1 18 18 SER C C 13 174.11 0.02 . . . . . . . 18 SER C . 52655 1 77 . 1 . 1 18 18 SER CA C 13 61.72 0.02 . . . . . . . 18 SER CA . 52655 1 78 . 1 . 1 18 18 SER CB C 13 69.58 0.02 . . . . . . . 18 SER CB . 52655 1 79 . 1 . 1 18 18 SER N N 15 115.80 0.04 . . . . . . . 18 SER N . 52655 1 80 . 1 . 1 19 19 LEU C C 13 176.84 0.02 . . . . . . . 19 LEU C . 52655 1 81 . 1 . 1 19 19 LEU CA C 13 58.32 0.02 . . . . . . . 19 LEU CA . 52655 1 82 . 1 . 1 19 19 LEU CB C 13 42.04 0.02 . . . . . . . 19 LEU CB . 52655 1 83 . 1 . 1 20 20 VAL H H 1 8.55 0.01 . . . . . . . 20 VAL HN . 52655 1 84 . 1 . 1 20 20 VAL C C 13 178.40 0.02 . . . . . . . 20 VAL C . 52655 1 85 . 1 . 1 20 20 VAL CA C 13 66.67 0.02 . . . . . . . 20 VAL CA . 52655 1 86 . 1 . 1 20 20 VAL CB C 13 31.62 0.02 . . . . . . . 20 VAL CB . 52655 1 87 . 1 . 1 20 20 VAL N N 15 118.61 0.04 . . . . . . . 20 VAL N . 52655 1 88 . 1 . 1 21 21 HIS H H 1 7.94 0.01 . . . . . . . 21 HIS HN . 52655 1 89 . 1 . 1 21 21 HIS HD2 H 1 7.27 0.01 . . . . . . . 21 HIS HD2 . 52655 1 90 . 1 . 1 21 21 HIS HE1 H 1 7.94 0.01 . . . . . . . 21 HIS HE1 . 52655 1 91 . 1 . 1 21 21 HIS C C 13 177.95 0.02 . . . . . . . 21 HIS C . 52655 1 92 . 1 . 1 21 21 HIS CA C 13 60.03 0.02 . . . . . . . 21 HIS CA . 52655 1 93 . 1 . 1 21 21 HIS CB C 13 27.55 0.02 . . . . . . . 21 HIS CB . 52655 1 94 . 1 . 1 21 21 HIS CD2 C 13 129.55 0.02 . . . . . . . 21 HIS CD2 . 52655 1 95 . 1 . 1 21 21 HIS CE1 C 13 139.72 0.02 . . . . . . . 21 HIS CE1 . 52655 1 96 . 1 . 1 21 21 HIS N N 15 115.63 0.04 . . . . . . . 21 HIS N . 52655 1 97 . 1 . 1 21 21 HIS ND1 N 15 172.61 0.04 . . . . . . . 21 HIS ND1 . 52655 1 98 . 1 . 1 21 21 HIS NE2 N 15 218.20 0.04 . . . . . . . 21 HIS NE2 . 52655 1 99 . 1 . 1 22 22 ALA H H 1 8.58 0.01 . . . . . . . 22 ALA HN . 52655 1 100 . 1 . 1 22 22 ALA C C 13 179.11 0.02 . . . . . . . 22 ALA C . 52655 1 101 . 1 . 1 22 22 ALA CA C 13 54.99 0.02 . . . . . . . 22 ALA CA . 52655 1 102 . 1 . 1 22 22 ALA CB C 13 19.62 0.02 . . . . . . . 22 ALA CB . 52655 1 103 . 1 . 1 22 22 ALA N N 15 121.32 0.04 . . . . . . . 22 ALA N . 52655 1 104 . 1 . 1 23 23 ALA H H 1 8.25 0.01 . . . . . . . 23 ALA HN . 52655 1 105 . 1 . 1 23 23 ALA C C 13 177.23 0.02 . . . . . . . 23 ALA C . 52655 1 106 . 1 . 1 23 23 ALA CA C 13 53.64 0.02 . . . . . . . 23 ALA CA . 52655 1 107 . 1 . 1 23 23 ALA CB C 13 18.20 0.02 . . . . . . . 23 ALA CB . 52655 1 108 . 1 . 1 23 23 ALA N N 15 116.31 0.04 . . . . . . . 23 ALA N . 52655 1 109 . 1 . 1 24 24 GLN H H 1 7.20 0.01 . . . . . . . 24 GLN HN . 52655 1 110 . 1 . 1 24 24 GLN C C 13 174.15 0.02 . . . . . . . 24 GLN C . 52655 1 111 . 1 . 1 24 24 GLN CA C 13 54.25 0.02 . . . . . . . 24 GLN CA . 52655 1 112 . 1 . 1 24 24 GLN CB C 13 30.44 0.02 . . . . . . . 24 GLN CB . 52655 1 113 . 1 . 1 24 24 GLN N N 15 111.66 0.04 . . . . . . . 24 GLN N . 52655 1 114 . 1 . 1 25 25 CYS H H 1 7.24 0.01 . . . . . . . 25 CYS HN . 52655 1 115 . 1 . 1 25 25 CYS C C 13 176.02 0.02 . . . . . . . 25 CYS C . 52655 1 116 . 1 . 1 25 25 CYS CA C 13 60.56 0.02 . . . . . . . 25 CYS CA . 52655 1 117 . 1 . 1 25 25 CYS CB C 13 28.92 0.02 . . . . . . . 25 CYS CB . 52655 1 118 . 1 . 1 25 25 CYS N N 15 124.36 0.04 . . . . . . . 25 CYS N . 52655 1 119 . 1 . 1 26 26 ARG H H 1 8.89 0.01 . . . . . . . 26 ARG HN . 52655 1 120 . 1 . 1 26 26 ARG C C 13 175.05 0.02 . . . . . . . 26 ARG C . 52655 1 121 . 1 . 1 26 26 ARG CA C 13 54.5 0.02 . . . . . . . 26 ARG CA . 52655 1 122 . 1 . 1 26 26 ARG CB C 13 29.99 0.02 . . . . . . . 26 ARG CB . 52655 1 123 . 1 . 1 26 26 ARG N N 15 129.54 0.04 . . . . . . . 26 ARG N . 52655 1 124 . 1 . 1 27 27 ASN H H 1 7.86 0.01 . . . . . . . 27 ASN HN . 52655 1 125 . 1 . 1 27 27 ASN C C 13 175.59 0.02 . . . . . . . 27 ASN C . 52655 1 126 . 1 . 1 27 27 ASN CA C 13 51.62 0.02 . . . . . . . 27 ASN CA . 52655 1 127 . 1 . 1 27 27 ASN CB C 13 38.78 0.02 . . . . . . . 27 ASN CB . 52655 1 128 . 1 . 1 27 27 ASN N N 15 120.28 0.04 . . . . . . . 27 ASN N . 52655 1 129 . 1 . 1 28 28 ALA H H 1 9.17 0.01 . . . . . . . 28 ALA HN . 52655 1 130 . 1 . 1 28 28 ALA C C 13 177.96 0.02 . . . . . . . 28 ALA C . 52655 1 131 . 1 . 1 28 28 ALA CA C 13 54.30 0.02 . . . . . . . 28 ALA CA . 52655 1 132 . 1 . 1 28 28 ALA CB C 13 18.16 0.02 . . . . . . . 28 ALA CB . 52655 1 133 . 1 . 1 28 28 ALA N N 15 130.31 0.04 . . . . . . . 28 ALA N . 52655 1 134 . 1 . 1 29 29 ASN H H 1 8.05 0.01 . . . . . . . 29 ASN HN . 52655 1 135 . 1 . 1 29 29 ASN C C 13 173.97 0.02 . . . . . . . 29 ASN C . 52655 1 136 . 1 . 1 29 29 ASN CA C 13 51.76 0.02 . . . . . . . 29 ASN CA . 52655 1 137 . 1 . 1 29 29 ASN CB C 13 38.62 0.02 . . . . . . . 29 ASN CB . 52655 1 138 . 1 . 1 29 29 ASN N N 15 113.97 0.04 . . . . . . . 29 ASN N . 52655 1 139 . 1 . 1 30 30 CYS H H 1 7.14 0.01 . . . . . . . 30 CYS HN . 52655 1 140 . 1 . 1 30 30 CYS C C 13 176.76 0.02 . . . . . . . 30 CYS C . 52655 1 141 . 1 . 1 30 30 CYS CA C 13 61.51 0.02 . . . . . . . 30 CYS CA . 52655 1 142 . 1 . 1 30 30 CYS CB C 13 29.79 0.02 . . . . . . . 30 CYS CB . 52655 1 143 . 1 . 1 30 30 CYS N N 15 123.09 0.04 . . . . . . . 30 CYS N . 52655 1 144 . 1 . 1 31 31 SER H H 1 8.84 0.01 . . . . . . . 31 SER HN . 52655 1 145 . 1 . 1 31 31 SER C C 13 174.68 0.02 . . . . . . . 31 SER C . 52655 1 146 . 1 . 1 31 31 SER CA C 13 57.78 0.02 . . . . . . . 31 SER CA . 52655 1 147 . 1 . 1 31 31 SER CB C 13 63.84 0.02 . . . . . . . 31 SER CB . 52655 1 148 . 1 . 1 31 31 SER N N 15 124.51 0.04 . . . . . . . 31 SER N . 52655 1 149 . 1 . 1 32 32 LEU H H 1 8.50 0.01 . . . . . . . 32 LEU HN . 52655 1 150 . 1 . 1 32 32 LEU C C 13 176.63 0.02 . . . . . . . 32 LEU C . 52655 1 151 . 1 . 1 32 32 LEU CA C 13 54.11 0.02 . . . . . . . 32 LEU CA . 52655 1 152 . 1 . 1 32 32 LEU CB C 13 40.62 0.02 . . . . . . . 32 LEU CB . 52655 1 153 . 1 . 1 32 32 LEU N N 15 128.65 0.04 . . . . . . . 32 LEU N . 52655 1 154 . 1 . 1 33 33 PRO C C 13 178.30 0.02 . . . . . . . 33 PRO C . 52655 1 155 . 1 . 1 33 33 PRO CA C 13 65.27 0.02 . . . . . . . 33 PRO CA . 52655 1 156 . 1 . 1 33 33 PRO CB C 13 31.72 0.02 . . . . . . . 33 PRO CB . 52655 1 157 . 1 . 1 34 34 SER H H 1 8.38 0.01 . . . . . . . 34 SER HN . 52655 1 158 . 1 . 1 34 34 SER C C 13 174.29 0.02 . . . . . . . 34 SER C . 52655 1 159 . 1 . 1 34 34 SER CA C 13 60.28 0.02 . . . . . . . 34 SER CA . 52655 1 160 . 1 . 1 34 34 SER CB C 13 62.69 0.02 . . . . . . . 34 SER CB . 52655 1 161 . 1 . 1 34 34 SER N N 15 111.97 0.04 . . . . . . . 34 SER N . 52655 1 162 . 1 . 1 35 35 CYS H H 1 7.50 0.01 . . . . . . . 35 CYS HN . 52655 1 163 . 1 . 1 35 35 CYS C C 13 176.52 0.02 . . . . . . . 35 CYS C . 52655 1 164 . 1 . 1 35 35 CYS CA C 13 63.64 0.02 . . . . . . . 35 CYS CA . 52655 1 165 . 1 . 1 35 35 CYS CB C 13 29.52 0.02 . . . . . . . 35 CYS CB . 52655 1 166 . 1 . 1 35 35 CYS N N 15 125.71 0.04 . . . . . . . 35 CYS N . 52655 1 167 . 1 . 1 36 36 GLN H H 1 8.20 0.01 . . . . . . . 36 GLN HN . 52655 1 168 . 1 . 1 36 36 GLN C C 13 179.20 0.02 . . . . . . . 36 GLN C . 52655 1 169 . 1 . 1 36 36 GLN CA C 13 59.71 0.02 . . . . . . . 36 GLN CA . 52655 1 170 . 1 . 1 36 36 GLN CB C 13 28.00 0.02 . . . . . . . 36 GLN CB . 52655 1 171 . 1 . 1 36 36 GLN N N 15 116.24 0.04 . . . . . . . 36 GLN N . 52655 1 172 . 1 . 1 37 37 LYS H H 1 8.01 0.01 . . . . . . . 37 LYS HN . 52655 1 173 . 1 . 1 37 37 LYS C C 13 179.32 0.02 . . . . . . . 37 LYS C . 52655 1 174 . 1 . 1 37 37 LYS CA C 13 59.40 0.02 . . . . . . . 37 LYS CA . 52655 1 175 . 1 . 1 37 37 LYS CB C 13 32.63 0.02 . . . . . . . 37 LYS CB . 52655 1 176 . 1 . 1 37 37 LYS N N 15 117.14 0.04 . . . . . . . 37 LYS N . 52655 1 177 . 1 . 1 38 38 MET H H 1 8.19 0.01 . . . . . . . 38 MET HN . 52655 1 178 . 1 . 1 38 38 MET C C 13 178.89 0.02 . . . . . . . 38 MET C . 52655 1 179 . 1 . 1 38 38 MET CA C 13 56.54 0.02 . . . . . . . 38 MET CA . 52655 1 180 . 1 . 1 38 38 MET CB C 13 31.63 0.02 . . . . . . . 38 MET CB . 52655 1 181 . 1 . 1 38 38 MET N N 15 118.06 0.04 . . . . . . . 38 MET N . 52655 1 182 . 1 . 1 39 39 LYS H H 1 9.60 0.01 . . . . . . . 39 LYS HN . 52655 1 183 . 1 . 1 39 39 LYS C C 13 179.61 0.02 . . . . . . . 39 LYS C . 52655 1 184 . 1 . 1 39 39 LYS CA C 13 61.27 0.02 . . . . . . . 39 LYS CA . 52655 1 185 . 1 . 1 39 39 LYS CB C 13 32.45 0.02 . . . . . . . 39 LYS CB . 52655 1 186 . 1 . 1 39 39 LYS N N 15 122.11 0.04 . . . . . . . 39 LYS N . 52655 1 187 . 1 . 1 40 40 ARG H H 1 7.55 0.01 . . . . . . . 40 ARG HN . 52655 1 188 . 1 . 1 40 40 ARG C C 13 179.65 0.02 . . . . . . . 40 ARG C . 52655 1 189 . 1 . 1 40 40 ARG CA C 13 59.45 0.02 . . . . . . . 40 ARG CA . 52655 1 190 . 1 . 1 40 40 ARG CB C 13 29.68 0.02 . . . . . . . 40 ARG CB . 52655 1 191 . 1 . 1 40 40 ARG N N 15 117.69 0.04 . . . . . . . 40 ARG N . 52655 1 192 . 1 . 1 41 41 VAL H H 1 7.54 0.01 . . . . . . . 41 VAL HN . 52655 1 193 . 1 . 1 41 41 VAL C C 13 177.83 0.02 . . . . . . . 41 VAL C . 52655 1 194 . 1 . 1 41 41 VAL CA C 13 66.31 0.02 . . . . . . . 41 VAL CA . 52655 1 195 . 1 . 1 41 41 VAL CB C 13 33.64 0.02 . . . . . . . 41 VAL CB . 52655 1 196 . 1 . 1 41 41 VAL N N 15 121.53 0.04 . . . . . . . 41 VAL N . 52655 1 197 . 1 . 1 42 42 VAL H H 1 8.48 0.01 . . . . . . . 42 VAL HN . 52655 1 198 . 1 . 1 42 42 VAL CA C 13 67.30 0.02 . . . . . . . 42 VAL CA . 52655 1 199 . 1 . 1 42 42 VAL CB C 13 31.98 0.02 . . . . . . . 42 VAL CB . 52655 1 200 . 1 . 1 42 42 VAL N N 15 120.83 0.04 . . . . . . . 42 VAL N . 52655 1 201 . 1 . 1 44 44 HIS HD2 H 1 6.94 0.01 . . . . . . . 44 HIS HD2 . 52655 1 202 . 1 . 1 44 44 HIS HE1 H 1 8.03 0.01 . . . . . . . 44 HIS HE1 . 52655 1 203 . 1 . 1 44 44 HIS C C 13 178.03 0.02 . . . . . . . 44 HIS C . 52655 1 204 . 1 . 1 44 44 HIS CA C 13 59.73 0.02 . . . . . . . 44 HIS CA . 52655 1 205 . 1 . 1 44 44 HIS CB C 13 27.11 0.02 . . . . . . . 44 HIS CB . 52655 1 206 . 1 . 1 44 44 HIS CD2 C 13 129.24 0.02 . . . . . . . 44 HIS CD2 . 52655 1 207 . 1 . 1 44 44 HIS CE1 C 13 140.12 0.02 . . . . . . . 44 HIS CE1 . 52655 1 208 . 1 . 1 44 44 HIS ND1 N 15 172.78 0.04 . . . . . . . 44 HIS ND1 . 52655 1 209 . 1 . 1 44 44 HIS NE2 N 15 219.62 0.04 . . . . . . . 44 HIS NE2 . 52655 1 210 . 1 . 1 45 45 THR H H 1 7.90 0.01 . . . . . . . 45 THR HN . 52655 1 211 . 1 . 1 45 45 THR C C 13 175.73 0.02 . . . . . . . 45 THR C . 52655 1 212 . 1 . 1 45 45 THR CA C 13 65.48 0.02 . . . . . . . 45 THR CA . 52655 1 213 . 1 . 1 45 45 THR CB C 13 69.44 0.02 . . . . . . . 45 THR CB . 52655 1 214 . 1 . 1 45 45 THR N N 15 110.25 0.04 . . . . . . . 45 THR N . 52655 1 215 . 1 . 1 46 46 LYS H H 1 7.27 0.01 . . . . . . . 46 LYS HN . 52655 1 216 . 1 . 1 46 46 LYS C C 13 177.67 0.02 . . . . . . . 46 LYS C . 52655 1 217 . 1 . 1 46 46 LYS CA C 13 58.47 0.02 . . . . . . . 46 LYS CA . 52655 1 218 . 1 . 1 46 46 LYS CB C 13 31.89 0.02 . . . . . . . 46 LYS CB . 52655 1 219 . 1 . 1 46 46 LYS N N 15 120.13 0.04 . . . . . . . 46 LYS N . 52655 1 220 . 1 . 1 47 47 GLY H H 1 7.16 0.01 . . . . . . . 47 GLY HN . 52655 1 221 . 1 . 1 47 47 GLY C C 13 173.69 0.02 . . . . . . . 47 GLY C . 52655 1 222 . 1 . 1 47 47 GLY CA C 13 44.50 0.02 . . . . . . . 47 GLY CA . 52655 1 223 . 1 . 1 47 47 GLY N N 15 103.95 0.04 . . . . . . . 47 GLY N . 52655 1 224 . 1 . 1 48 48 CYS H H 1 6.88 0.01 . . . . . . . 48 CYS HN . 52655 1 225 . 1 . 1 48 48 CYS C C 13 176.61 0.02 . . . . . . . 48 CYS C . 52655 1 226 . 1 . 1 48 48 CYS CA C 13 60.86 0.02 . . . . . . . 48 CYS CA . 52655 1 227 . 1 . 1 48 48 CYS CB C 13 29.63 0.02 . . . . . . . 48 CYS CB . 52655 1 228 . 1 . 1 48 48 CYS N N 15 123.20 0.04 . . . . . . . 48 CYS N . 52655 1 229 . 1 . 1 49 49 LYS H H 1 9.00 0.01 . . . . . . . 49 LYS HN . 52655 1 230 . 1 . 1 49 49 LYS C C 13 177.36 0.02 . . . . . . . 49 LYS C . 52655 1 231 . 1 . 1 49 49 LYS CA C 13 56.35 0.02 . . . . . . . 49 LYS CA . 52655 1 232 . 1 . 1 49 49 LYS CB C 13 32.61 0.02 . . . . . . . 49 LYS CB . 52655 1 233 . 1 . 1 49 49 LYS N N 15 128.10 0.04 . . . . . . . 49 LYS N . 52655 1 234 . 1 . 1 50 50 ARG H H 1 8.51 0.01 . . . . . . . 50 ARG HN . 52655 1 235 . 1 . 1 50 50 ARG C C 13 176.75 0.02 . . . . . . . 50 ARG C . 52655 1 236 . 1 . 1 50 50 ARG CA C 13 57.40 0.02 . . . . . . . 50 ARG CA . 52655 1 237 . 1 . 1 50 50 ARG CB C 13 31.51 0.02 . . . . . . . 50 ARG CB . 52655 1 238 . 1 . 1 50 50 ARG N N 15 122.47 0.04 . . . . . . . 50 ARG N . 52655 1 239 . 1 . 1 51 51 LYS H H 1 8.45 0.01 . . . . . . . 51 LYS HN . 52655 1 240 . 1 . 1 51 51 LYS C C 13 177.10 0.02 . . . . . . . 51 LYS C . 52655 1 241 . 1 . 1 51 51 LYS CA C 13 57.49 0.02 . . . . . . . 51 LYS CA . 52655 1 242 . 1 . 1 51 51 LYS CB C 13 32.03 0.02 . . . . . . . 51 LYS CB . 52655 1 243 . 1 . 1 51 51 LYS N N 15 118.73 0.04 . . . . . . . 51 LYS N . 52655 1 244 . 1 . 1 52 52 THR H H 1 7.82 0.01 . . . . . . . 52 THR HN . 52655 1 245 . 1 . 1 52 52 THR C C 13 175.91 0.02 . . . . . . . 52 THR C . 52655 1 246 . 1 . 1 52 52 THR CA C 13 63.72 0.02 . . . . . . . 52 THR CA . 52655 1 247 . 1 . 1 52 52 THR CB C 13 68.45 0.02 . . . . . . . 52 THR CB . 52655 1 248 . 1 . 1 52 52 THR N N 15 113.24 0.04 . . . . . . . 52 THR N . 52655 1 249 . 1 . 1 53 53 ASN H H 1 8.37 0.01 . . . . . . . 53 ASN HN . 52655 1 250 . 1 . 1 53 53 ASN C C 13 175.86 0.02 . . . . . . . 53 ASN C . 52655 1 251 . 1 . 1 53 53 ASN CA C 13 53.87 0.02 . . . . . . . 53 ASN CA . 52655 1 252 . 1 . 1 53 53 ASN CB C 13 38.08 0.02 . . . . . . . 53 ASN CB . 52655 1 253 . 1 . 1 53 53 ASN N N 15 119.66 0.04 . . . . . . . 53 ASN N . 52655 1 254 . 1 . 1 54 54 GLY H H 1 7.96 0.01 . . . . . . . 54 GLY HN . 52655 1 255 . 1 . 1 54 54 GLY C C 13 175.06 0.02 . . . . . . . 54 GLY C . 52655 1 256 . 1 . 1 54 54 GLY CA C 13 45.62 0.02 . . . . . . . 54 GLY CA . 52655 1 257 . 1 . 1 54 54 GLY N N 15 107.36 0.04 . . . . . . . 54 GLY N . 52655 1 258 . 1 . 1 55 55 GLY H H 1 7.81 0.01 . . . . . . . 55 GLY HN . 52655 1 259 . 1 . 1 55 55 GLY C C 13 173.19 0.02 . . . . . . . 55 GLY C . 52655 1 260 . 1 . 1 55 55 GLY CA C 13 45.37 0.02 . . . . . . . 55 GLY CA . 52655 1 261 . 1 . 1 55 55 GLY N N 15 107.20 0.04 . . . . . . . 55 GLY N . 52655 1 262 . 1 . 1 56 56 CYS H H 1 8.03 0.01 . . . . . . . 56 CYS HN . 52655 1 263 . 1 . 1 56 56 CYS C C 13 174.48 0.02 . . . . . . . 56 CYS C . 52655 1 264 . 1 . 1 56 56 CYS CA C 13 59.67 0.02 . . . . . . . 56 CYS CA . 52655 1 265 . 1 . 1 56 56 CYS CB C 13 30.42 0.02 . . . . . . . 56 CYS CB . 52655 1 266 . 1 . 1 56 56 CYS N N 15 122.43 0.04 . . . . . . . 56 CYS N . 52655 1 267 . 1 . 1 57 57 PRO C C 13 178.79 0.02 . . . . . . . 57 PRO C . 52655 1 268 . 1 . 1 57 57 PRO CA C 13 64.82 0.02 . . . . . . . 57 PRO CA . 52655 1 269 . 1 . 1 57 57 PRO CB C 13 32.14 0.02 . . . . . . . 57 PRO CB . 52655 1 270 . 1 . 1 58 58 VAL H H 1 7.81 0.01 . . . . . . . 58 VAL HN . 52655 1 271 . 1 . 1 58 58 VAL C C 13 178.91 0.02 . . . . . . . 58 VAL C . 52655 1 272 . 1 . 1 58 58 VAL CA C 13 65.92 0.02 . . . . . . . 58 VAL CA . 52655 1 273 . 1 . 1 58 58 VAL CB C 13 32.47 0.02 . . . . . . . 58 VAL CB . 52655 1 274 . 1 . 1 58 58 VAL N N 15 122.50 0.04 . . . . . . . 58 VAL N . 52655 1 275 . 1 . 1 59 59 CYS H H 1 8.90 0.01 . . . . . . . 59 CYS HN . 52655 1 276 . 1 . 1 59 59 CYS C C 13 177.51 0.02 . . . . . . . 59 CYS C . 52655 1 277 . 1 . 1 59 59 CYS CA C 13 66.07 0.02 . . . . . . . 59 CYS CA . 52655 1 278 . 1 . 1 59 59 CYS CB C 13 29.16 0.02 . . . . . . . 59 CYS CB . 52655 1 279 . 1 . 1 59 59 CYS N N 15 124.25 0.04 . . . . . . . 59 CYS N . 52655 1 280 . 1 . 1 60 60 LYS H H 1 8.09 0.01 . . . . . . . 60 LYS HN . 52655 1 281 . 1 . 1 60 60 LYS C C 13 179.07 0.02 . . . . . . . 60 LYS C . 52655 1 282 . 1 . 1 60 60 LYS CA C 13 59.92 0.02 . . . . . . . 60 LYS CA . 52655 1 283 . 1 . 1 60 60 LYS CB C 13 32.35 0.02 . . . . . . . 60 LYS CB . 52655 1 284 . 1 . 1 60 60 LYS N N 15 117.33 0.04 . . . . . . . 60 LYS N . 52655 1 285 . 1 . 1 61 61 GLN H H 1 7.38 0.01 . . . . . . . 61 GLN HN . 52655 1 286 . 1 . 1 61 61 GLN C C 13 178.25 0.02 . . . . . . . 61 GLN C . 52655 1 287 . 1 . 1 61 61 GLN CA C 13 58.28 0.02 . . . . . . . 61 GLN CA . 52655 1 288 . 1 . 1 61 61 GLN CB C 13 28.22 0.02 . . . . . . . 61 GLN CB . 52655 1 289 . 1 . 1 61 61 GLN N N 15 118.00 0.04 . . . . . . . 61 GLN N . 52655 1 290 . 1 . 1 62 62 LEU H H 1 7.81 0.01 . . . . . . . 62 LEU HN . 52655 1 291 . 1 . 1 62 62 LEU C C 13 178.93 0.02 . . . . . . . 62 LEU C . 52655 1 292 . 1 . 1 62 62 LEU CA C 13 57.67 0.02 . . . . . . . 62 LEU CA . 52655 1 293 . 1 . 1 62 62 LEU CB C 13 41.61 0.02 . . . . . . . 62 LEU CB . 52655 1 294 . 1 . 1 62 62 LEU N N 15 120.62 0.04 . . . . . . . 62 LEU N . 52655 1 295 . 1 . 1 63 63 ILE H H 1 8.48 0.01 . . . . . . . 63 ILE HN . 52655 1 296 . 1 . 1 63 63 ILE C C 13 176.93 0.02 . . . . . . . 63 ILE C . 52655 1 297 . 1 . 1 63 63 ILE CA C 13 65.42 0.02 . . . . . . . 63 ILE CA . 52655 1 298 . 1 . 1 63 63 ILE CB C 13 37.32 0.02 . . . . . . . 63 ILE CB . 52655 1 299 . 1 . 1 63 63 ILE N N 15 120.27 0.04 . . . . . . . 63 ILE N . 52655 1 300 . 1 . 1 64 64 ALA H H 1 7.31 0.01 . . . . . . . 64 ALA HN . 52655 1 301 . 1 . 1 64 64 ALA C C 13 180.79 0.02 . . . . . . . 64 ALA C . 52655 1 302 . 1 . 1 64 64 ALA CA C 13 54.88 0.02 . . . . . . . 64 ALA CA . 52655 1 303 . 1 . 1 64 64 ALA CB C 13 17.79 0.02 . . . . . . . 64 ALA CB . 52655 1 304 . 1 . 1 64 64 ALA N N 15 121.68 0.04 . . . . . . . 64 ALA N . 52655 1 305 . 1 . 1 65 65 LEU H H 1 7.55 0.01 . . . . . . . 65 LEU HN . 52655 1 306 . 1 . 1 65 65 LEU C C 13 178.97 0.02 . . . . . . . 65 LEU C . 52655 1 307 . 1 . 1 65 65 LEU CA C 13 57.55 0.02 . . . . . . . 65 LEU CA . 52655 1 308 . 1 . 1 65 65 LEU CB C 13 42.45 0.02 . . . . . . . 65 LEU CB . 52655 1 309 . 1 . 1 65 65 LEU N N 15 117.52 0.04 . . . . . . . 65 LEU N . 52655 1 310 . 1 . 1 66 66 ALA H H 1 8.87 0.01 . . . . . . . 66 ALA HN . 52655 1 311 . 1 . 1 66 66 ALA C C 13 179.30 0.02 . . . . . . . 66 ALA C . 52655 1 312 . 1 . 1 66 66 ALA CA C 13 55.63 0.02 . . . . . . . 66 ALA CA . 52655 1 313 . 1 . 1 66 66 ALA CB C 13 18.94 0.02 . . . . . . . 66 ALA CB . 52655 1 314 . 1 . 1 66 66 ALA N N 15 121.48 0.04 . . . . . . . 66 ALA N . 52655 1 315 . 1 . 1 67 67 ALA H H 1 8.60 0.01 . . . . . . . 67 ALA HN . 52655 1 316 . 1 . 1 67 67 ALA C C 13 179.73 0.02 . . . . . . . 67 ALA C . 52655 1 317 . 1 . 1 67 67 ALA CA C 13 55.41 0.02 . . . . . . . 67 ALA CA . 52655 1 318 . 1 . 1 67 67 ALA CB C 13 17.55 0.02 . . . . . . . 67 ALA CB . 52655 1 319 . 1 . 1 67 67 ALA N N 15 119.33 0.04 . . . . . . . 67 ALA N . 52655 1 320 . 1 . 1 68 68 TYR H H 1 7.51 0.01 . . . . . . . 68 TYR HN . 52655 1 321 . 1 . 1 68 68 TYR C C 13 178.83 0.02 . . . . . . . 68 TYR C . 52655 1 322 . 1 . 1 68 68 TYR CA C 13 61.13 0.02 . . . . . . . 68 TYR CA . 52655 1 323 . 1 . 1 68 68 TYR CB C 13 38.34 0.02 . . . . . . . 68 TYR CB . 52655 1 324 . 1 . 1 68 68 TYR N N 15 117.63 0.04 . . . . . . . 68 TYR N . 52655 1 325 . 1 . 1 69 69 HIS HD2 H 1 7.20 0.01 . . . . . . . 69 HIS HD2 . 52655 1 326 . 1 . 1 69 69 HIS HE1 H 1 8.06 0.01 . . . . . . . 69 HIS HE1 . 52655 1 327 . 1 . 1 69 69 HIS C C 13 176.72 0.02 . . . . . . . 69 HIS C . 52655 1 328 . 1 . 1 69 69 HIS CA C 13 58.59 0.02 . . . . . . . 69 HIS CA . 52655 1 329 . 1 . 1 69 69 HIS CB C 13 27.75 0.02 . . . . . . . 69 HIS CB . 52655 1 330 . 1 . 1 69 69 HIS CD2 C 13 129.99 0.02 . . . . . . . 69 HIS CD2 . 52655 1 331 . 1 . 1 69 69 HIS CE1 C 13 140.58 0.02 . . . . . . . 69 HIS CE1 . 52655 1 332 . 1 . 1 69 69 HIS ND1 N 15 172.10 0.04 . . . . . . . 69 HIS ND1 . 52655 1 333 . 1 . 1 69 69 HIS NE2 N 15 221.4 0.04 . . . . . . . 69 HIS NE2 . 52655 1 334 . 1 . 1 70 70 ALA H H 1 9.22 0.01 . . . . . . . 70 ALA HN . 52655 1 335 . 1 . 1 70 70 ALA C C 13 178.67 0.02 . . . . . . . 70 ALA C . 52655 1 336 . 1 . 1 70 70 ALA CA C 13 54.60 0.02 . . . . . . . 70 ALA CA . 52655 1 337 . 1 . 1 70 70 ALA CB C 13 19.75 0.02 . . . . . . . 70 ALA CB . 52655 1 338 . 1 . 1 70 70 ALA N N 15 122.06 0.04 . . . . . . . 70 ALA N . 52655 1 339 . 1 . 1 71 71 LYS H H 1 6.91 0.01 . . . . . . . 71 LYS HN . 52655 1 340 . 1 . 1 71 71 LYS C C 13 176.37 0.02 . . . . . . . 71 LYS C . 52655 1 341 . 1 . 1 71 71 LYS CA C 13 58.29 0.02 . . . . . . . 71 LYS CA . 52655 1 342 . 1 . 1 71 71 LYS CB C 13 32.44 0.02 . . . . . . . 71 LYS CB . 52655 1 343 . 1 . 1 71 71 LYS N N 15 113.56 0.04 . . . . . . . 71 LYS N . 52655 1 344 . 1 . 1 72 72 HIS H H 1 7.10 0.01 . . . . . . . 72 HIS HN . 52655 1 345 . 1 . 1 72 72 HIS C C 13 173.32 0.02 . . . . . . . 72 HIS C . 52655 1 346 . 1 . 1 72 72 HIS CA C 13 53.91 0.02 . . . . . . . 72 HIS CA . 52655 1 347 . 1 . 1 72 72 HIS CB C 13 30.05 0.02 . . . . . . . 72 HIS CB . 52655 1 348 . 1 . 1 72 72 HIS N N 15 112.47 0.04 . . . . . . . 72 HIS N . 52655 1 349 . 1 . 1 73 73 CYS H H 1 6.91 0.01 . . . . . . . 73 CYS HN . 52655 1 350 . 1 . 1 73 73 CYS C C 13 176.06 0.02 . . . . . . . 73 CYS C . 52655 1 351 . 1 . 1 73 73 CYS CA C 13 59.82 0.02 . . . . . . . 73 CYS CA . 52655 1 352 . 1 . 1 73 73 CYS CB C 13 29.78 0.02 . . . . . . . 73 CYS CB . 52655 1 353 . 1 . 1 73 73 CYS N N 15 123.27 0.04 . . . . . . . 73 CYS N . 52655 1 354 . 1 . 1 74 74 GLN H H 1 9.17 0.01 . . . . . . . 74 GLN HN . 52655 1 355 . 1 . 1 74 74 GLN C C 13 175.49 0.02 . . . . . . . 74 GLN C . 52655 1 356 . 1 . 1 74 74 GLN CA C 13 54.51 0.02 . . . . . . . 74 GLN CA . 52655 1 357 . 1 . 1 74 74 GLN CB C 13 29.60 0.02 . . . . . . . 74 GLN CB . 52655 1 358 . 1 . 1 74 74 GLN N N 15 128.52 0.04 . . . . . . . 74 GLN N . 52655 1 359 . 1 . 1 75 75 GLU C C 13 176.65 0.02 . . . . . . . 75 GLU C . 52655 1 360 . 1 . 1 75 75 GLU CA C 13 55.56 0.02 . . . . . . . 75 GLU CA . 52655 1 361 . 1 . 1 75 75 GLU CB C 13 30.11 0.02 . . . . . . . 75 GLU CB . 52655 1 362 . 1 . 1 76 76 ASN H H 1 9.00 0.01 . . . . . . . 76 ASN HN . 52655 1 363 . 1 . 1 76 76 ASN C C 13 175.81 0.02 . . . . . . . 76 ASN C . 52655 1 364 . 1 . 1 76 76 ASN CA C 13 55.07 0.02 . . . . . . . 76 ASN CA . 52655 1 365 . 1 . 1 76 76 ASN CB C 13 38.22 0.02 . . . . . . . 76 ASN CB . 52655 1 366 . 1 . 1 76 76 ASN N N 15 126.17 0.04 . . . . . . . 76 ASN N . 52655 1 367 . 1 . 1 77 77 LYS H H 1 8.81 0.01 . . . . . . . 77 LYS HN . 52655 1 368 . 1 . 1 77 77 LYS C C 13 174.77 0.02 . . . . . . . 77 LYS C . 52655 1 369 . 1 . 1 77 77 LYS CA C 13 54.22 0.02 . . . . . . . 77 LYS CA . 52655 1 370 . 1 . 1 77 77 LYS CB C 13 30.74 0.02 . . . . . . . 77 LYS CB . 52655 1 371 . 1 . 1 77 77 LYS N N 15 120.79 0.04 . . . . . . . 77 LYS N . 52655 1 372 . 1 . 1 78 78 CYS H H 1 6.78 0.01 . . . . . . . 78 CYS HN . 52655 1 373 . 1 . 1 78 78 CYS C C 13 175.83 0.02 . . . . . . . 78 CYS C . 52655 1 374 . 1 . 1 78 78 CYS CA C 13 57.78 0.02 . . . . . . . 78 CYS CA . 52655 1 375 . 1 . 1 78 78 CYS CB C 13 30.41 0.02 . . . . . . . 78 CYS CB . 52655 1 376 . 1 . 1 78 78 CYS N N 15 123.52 0.04 . . . . . . . 78 CYS N . 52655 1 377 . 1 . 1 79 79 PRO C C 13 176.77 0.02 . . . . . . . 79 PRO C . 52655 1 378 . 1 . 1 79 79 PRO CA C 13 62.74 0.02 . . . . . . . 79 PRO CA . 52655 1 379 . 1 . 1 79 79 PRO CB C 13 31.88 0.02 . . . . . . . 79 PRO CB . 52655 1 380 . 1 . 1 80 80 VAL H H 1 9.06 0.01 . . . . . . . 80 VAL HN . 52655 1 381 . 1 . 1 80 80 VAL C C 13 173.96 0.02 . . . . . . . 80 VAL C . 52655 1 382 . 1 . 1 80 80 VAL CA C 13 62.23 0.02 . . . . . . . 80 VAL CA . 52655 1 383 . 1 . 1 80 80 VAL CB C 13 32.61 0.02 . . . . . . . 80 VAL CB . 52655 1 384 . 1 . 1 80 80 VAL N N 15 128.05 0.04 . . . . . . . 80 VAL N . 52655 1 385 . 1 . 1 82 82 PHE H H 1 8.01 0.01 . . . . . . . 82 PHE HN . 52655 1 386 . 1 . 1 82 82 PHE C C 13 175.35 0.02 . . . . . . . 82 PHE C . 52655 1 387 . 1 . 1 82 82 PHE CA C 13 60.74 0.02 . . . . . . . 82 PHE CA . 52655 1 388 . 1 . 1 82 82 PHE CB C 13 37.02 0.02 . . . . . . . 82 PHE CB . 52655 1 389 . 1 . 1 82 82 PHE N N 15 111.25 0.04 . . . . . . . 82 PHE N . 52655 1 390 . 1 . 1 83 83 CYS H H 1 7.78 0.01 . . . . . . . 83 CYS HN . 52655 1 391 . 1 . 1 83 83 CYS C C 13 176.83 0.02 . . . . . . . 83 CYS C . 52655 1 392 . 1 . 1 83 83 CYS CA C 13 64.88 0.02 . . . . . . . 83 CYS CA . 52655 1 393 . 1 . 1 83 83 CYS CB C 13 29.87 0.02 . . . . . . . 83 CYS CB . 52655 1 394 . 1 . 1 83 83 CYS N N 15 123.80 0.04 . . . . . . . 83 CYS N . 52655 1 395 . 1 . 1 97 97 HIS C C 13 175.97 0.02 . . . . . . . 97 HIS C . 52655 1 396 . 1 . 1 97 97 HIS CA C 13 56.26 0.02 . . . . . . . 97 HIS CA . 52655 1 397 . 1 . 1 97 97 HIS CB C 13 29.39 0.02 . . . . . . . 97 HIS CB . 52655 1 398 . 1 . 1 98 98 ARG H H 1 8.35 0.01 . . . . . . . 98 ARG HN . 52655 1 399 . 1 . 1 98 98 ARG C C 13 176.07 0.02 . . . . . . . 98 ARG C . 52655 1 400 . 1 . 1 98 98 ARG CA C 13 56.03 0.02 . . . . . . . 98 ARG CA . 52655 1 401 . 1 . 1 98 98 ARG CB C 13 28.96 0.02 . . . . . . . 98 ARG CB . 52655 1 402 . 1 . 1 98 98 ARG N N 15 121.46 0.04 . . . . . . . 98 ARG N . 52655 1 403 . 1 . 1 99 99 LEU H H 1 8.26 0.01 . . . . . . . 99 LEU HN . 52655 1 404 . 1 . 1 99 99 LEU C C 13 177.38 0.02 . . . . . . . 99 LEU C . 52655 1 405 . 1 . 1 99 99 LEU CA C 13 55.32 0.02 . . . . . . . 99 LEU CA . 52655 1 406 . 1 . 1 99 99 LEU CB C 13 42.24 0.02 . . . . . . . 99 LEU CB . 52655 1 407 . 1 . 1 99 99 LEU N N 15 122.81 0.04 . . . . . . . 99 LEU N . 52655 1 408 . 1 . 1 100 100 GLN H H 1 8.33 0.01 . . . . . . . 100 GLN HN . 52655 1 409 . 1 . 1 100 100 GLN C C 13 176.28 0.02 . . . . . . . 100 GLN C . 52655 1 410 . 1 . 1 100 100 GLN CA C 13 56.43 0.02 . . . . . . . 100 GLN CA . 52655 1 411 . 1 . 1 100 100 GLN CB C 13 30.19 0.02 . . . . . . . 100 GLN CB . 52655 1 412 . 1 . 1 100 100 GLN N N 15 120.74 0.04 . . . . . . . 100 GLN N . 52655 1 413 . 1 . 1 101 101 GLN H H 1 8.33 0.01 . . . . . . . 101 GLN HN . 52655 1 414 . 1 . 1 101 101 GLN C C 13 177.66 0.02 . . . . . . . 101 GLN C . 52655 1 415 . 1 . 1 101 101 GLN CA C 13 57.94 0.02 . . . . . . . 101 GLN CA . 52655 1 416 . 1 . 1 101 101 GLN CB C 13 29.17 0.02 . . . . . . . 101 GLN CB . 52655 1 417 . 1 . 1 101 101 GLN N N 15 120.58 0.04 . . . . . . . 101 GLN N . 52655 1 418 . 1 . 1 102 102 ALA H H 1 8.09 0.01 . . . . . . . 102 ALA HN . 52655 1 419 . 1 . 1 102 102 ALA C C 13 179.73 0.02 . . . . . . . 102 ALA C . 52655 1 420 . 1 . 1 102 102 ALA CA C 13 54.26 0.02 . . . . . . . 102 ALA CA . 52655 1 421 . 1 . 1 102 102 ALA CB C 13 18.11 0.02 . . . . . . . 102 ALA CB . 52655 1 422 . 1 . 1 102 102 ALA N N 15 122.63 0.04 . . . . . . . 102 ALA N . 52655 1 423 . 1 . 1 103 103 GLN H H 1 8.03 0.01 . . . . . . . 103 GLN HN . 52655 1 424 . 1 . 1 103 103 GLN C C 13 177.82 0.02 . . . . . . . 103 GLN C . 52655 1 425 . 1 . 1 103 103 GLN CA C 13 57.72 0.02 . . . . . . . 103 GLN CA . 52655 1 426 . 1 . 1 103 103 GLN CB C 13 28.45 0.02 . . . . . . . 103 GLN CB . 52655 1 427 . 1 . 1 103 103 GLN N N 15 118.03 0.04 . . . . . . . 103 GLN N . 52655 1 428 . 1 . 1 104 104 LEU H H 1 7.97 0.01 . . . . . . . 104 LEU HN . 52655 1 429 . 1 . 1 104 104 LEU C C 13 178.76 0.02 . . . . . . . 104 LEU C . 52655 1 430 . 1 . 1 104 104 LEU CA C 13 57.03 0.02 . . . . . . . 104 LEU CA . 52655 1 431 . 1 . 1 104 104 LEU CB C 13 41.81 0.02 . . . . . . . 104 LEU CB . 52655 1 432 . 1 . 1 104 104 LEU N N 15 121.20 0.04 . . . . . . . 104 LEU N . 52655 1 433 . 1 . 1 105 105 MET H H 1 8.05 0.01 . . . . . . . 105 MET HN . 52655 1 434 . 1 . 1 105 105 MET C C 13 177.48 0.02 . . . . . . . 105 MET C . 52655 1 435 . 1 . 1 105 105 MET CA C 13 56.94 0.02 . . . . . . . 105 MET CA . 52655 1 436 . 1 . 1 105 105 MET CB C 13 31.96 0.02 . . . . . . . 105 MET CB . 52655 1 437 . 1 . 1 105 105 MET N N 15 118.76 0.04 . . . . . . . 105 MET N . 52655 1 438 . 1 . 1 109 109 MET C C 13 176.56 0.02 . . . . . . . 109 MET C . 52655 1 439 . 1 . 1 109 109 MET CA C 13 55.95 0.02 . . . . . . . 109 MET CA . 52655 1 440 . 1 . 1 109 109 MET CB C 13 32.67 0.02 . . . . . . . 109 MET CB . 52655 1 441 . 1 . 1 110 110 ALA H H 1 8.13 0.01 . . . . . . . 110 ALA HN . 52655 1 442 . 1 . 1 110 110 ALA C C 13 178.22 0.02 . . . . . . . 110 ALA C . 52655 1 443 . 1 . 1 110 110 ALA CA C 13 52.89 0.02 . . . . . . . 110 ALA CA . 52655 1 444 . 1 . 1 110 110 ALA CB C 13 18.90 0.02 . . . . . . . 110 ALA CB . 52655 1 445 . 1 . 1 110 110 ALA N N 15 123.76 0.04 . . . . . . . 110 ALA N . 52655 1 446 . 1 . 1 111 111 THR H H 1 7.97 0.01 . . . . . . . 111 THR HN . 52655 1 447 . 1 . 1 111 111 THR C C 13 174.82 0.02 . . . . . . . 111 THR C . 52655 1 448 . 1 . 1 111 111 THR CA C 13 62.05 0.02 . . . . . . . 111 THR CA . 52655 1 449 . 1 . 1 111 111 THR CB C 13 69.50 0.02 . . . . . . . 111 THR CB . 52655 1 450 . 1 . 1 111 111 THR N N 15 112.01 0.04 . . . . . . . 111 THR N . 52655 1 451 . 1 . 1 112 112 MET H H 1 8.20 0.01 . . . . . . . 112 MET HN . 52655 1 452 . 1 . 1 112 112 MET C C 13 175.92 0.02 . . . . . . . 112 MET C . 52655 1 453 . 1 . 1 112 112 MET CA C 13 55.74 0.02 . . . . . . . 112 MET CA . 52655 1 454 . 1 . 1 112 112 MET CB C 13 32.69 0.02 . . . . . . . 112 MET CB . 52655 1 455 . 1 . 1 112 112 MET N N 15 121.99 0.04 . . . . . . . 112 MET N . 52655 1 456 . 1 . 1 113 113 ASN H H 1 8.43 0.01 . . . . . . . 113 ASN HN . 52655 1 457 . 1 . 1 113 113 ASN C C 13 175.42 0.02 . . . . . . . 113 ASN C . 52655 1 458 . 1 . 1 113 113 ASN CA C 13 53.16 0.02 . . . . . . . 113 ASN CA . 52655 1 459 . 1 . 1 113 113 ASN CB C 13 38.62 0.02 . . . . . . . 113 ASN CB . 52655 1 460 . 1 . 1 113 113 ASN N N 15 119.72 0.04 . . . . . . . 113 ASN N . 52655 1 461 . 1 . 1 114 114 THR H H 1 8.09 0.01 . . . . . . . 114 THR HN . 52655 1 462 . 1 . 1 114 114 THR C C 13 174.50 0.02 . . . . . . . 114 THR C . 52655 1 463 . 1 . 1 114 114 THR CA C 13 61.99 0.02 . . . . . . . 114 THR CA . 52655 1 464 . 1 . 1 114 114 THR CB C 13 69.56 0.02 . . . . . . . 114 THR CB . 52655 1 465 . 1 . 1 114 114 THR N N 15 114.28 0.04 . . . . . . . 114 THR N . 52655 1 466 . 1 . 1 115 115 ARG H H 1 8.28 0.01 . . . . . . . 115 ARG HN . 52655 1 467 . 1 . 1 115 115 ARG C C 13 175.80 0.02 . . . . . . . 115 ARG C . 52655 1 468 . 1 . 1 115 115 ARG CA C 13 56.13 0.02 . . . . . . . 115 ARG CA . 52655 1 469 . 1 . 1 115 115 ARG CB C 13 30.57 0.02 . . . . . . . 115 ARG CB . 52655 1 470 . 1 . 1 115 115 ARG N N 15 122.56 0.04 . . . . . . . 115 ARG N . 52655 1 471 . 1 . 1 116 116 ASN H H 1 8.42 0.01 . . . . . . . 116 ASN HN . 52655 1 472 . 1 . 1 116 116 ASN C C 13 174.59 0.02 . . . . . . . 116 ASN C . 52655 1 473 . 1 . 1 116 116 ASN CA C 13 52.97 0.02 . . . . . . . 116 ASN CA . 52655 1 474 . 1 . 1 116 116 ASN CB C 13 38.64 0.02 . . . . . . . 116 ASN CB . 52655 1 475 . 1 . 1 116 116 ASN N N 15 119.98 0.04 . . . . . . . 116 ASN N . 52655 1 476 . 1 . 1 117 117 VAL H H 1 8.04 0.01 . . . . . . . 117 VAL HN . 52655 1 477 . 1 . 1 117 117 VAL C C 13 174.29 0.02 . . . . . . . 117 VAL C . 52655 1 478 . 1 . 1 117 117 VAL CA C 13 59.55 0.02 . . . . . . . 117 VAL CA . 52655 1 479 . 1 . 1 117 117 VAL CB C 13 32.36 0.02 . . . . . . . 117 VAL CB . 52655 1 480 . 1 . 1 117 117 VAL N N 15 121.59 0.04 . . . . . . . 117 VAL N . 52655 1 481 . 1 . 1 118 118 PRO C C 13 176.85 0.02 . . . . . . . 118 PRO C . 52655 1 482 . 1 . 1 118 118 PRO CA C 13 63.21 0.02 . . . . . . . 118 PRO CA . 52655 1 483 . 1 . 1 118 118 PRO CB C 13 31.87 0.02 . . . . . . . 118 PRO CB . 52655 1 484 . 1 . 1 118 118 PRO N N 15 139.36 0.04 . . . . . . . 118 PRO N . 52655 1 485 . 1 . 1 119 119 GLN H H 1 8.50 0.01 . . . . . . . 119 GLN HN . 52655 1 486 . 1 . 1 119 119 GLN C C 13 176.02 0.02 . . . . . . . 119 GLN C . 52655 1 487 . 1 . 1 119 119 GLN CA C 13 55.64 0.02 . . . . . . . 119 GLN CA . 52655 1 488 . 1 . 1 119 119 GLN CB C 13 29.35 0.02 . . . . . . . 119 GLN CB . 52655 1 489 . 1 . 1 119 119 GLN N N 15 120.93 0.04 . . . . . . . 119 GLN N . 52655 1 490 . 1 . 1 120 120 GLN H H 1 8.46 0.01 . . . . . . . 120 GLN HN . 52655 1 491 . 1 . 1 120 120 GLN C C 13 175.71 0.02 . . . . . . . 120 GLN C . 52655 1 492 . 1 . 1 120 120 GLN CA C 13 55.76 0.02 . . . . . . . 120 GLN CA . 52655 1 493 . 1 . 1 120 120 GLN CB C 13 29.54 0.02 . . . . . . . 120 GLN CB . 52655 1 494 . 1 . 1 120 120 GLN N N 15 121.56 0.04 . . . . . . . 120 GLN N . 52655 1 495 . 1 . 1 121 121 SER H H 1 8.38 0.01 . . . . . . . 121 SER HN . 52655 1 496 . 1 . 1 121 121 SER C C 13 173.85 0.02 . . . . . . . 121 SER C . 52655 1 497 . 1 . 1 121 121 SER CA C 13 57.96 0.02 . . . . . . . 121 SER CA . 52655 1 498 . 1 . 1 121 121 SER CB C 13 63.66 0.02 . . . . . . . 121 SER CB . 52655 1 499 . 1 . 1 121 121 SER N N 15 117.55 0.04 . . . . . . . 121 SER N . 52655 1 500 . 1 . 1 122 122 LEU H H 1 8.26 0.01 . . . . . . . 122 LEU HN . 52655 1 501 . 1 . 1 122 122 LEU C C 13 175.09 0.02 . . . . . . . 122 LEU C . 52655 1 502 . 1 . 1 122 122 LEU CA C 13 52.77 0.02 . . . . . . . 122 LEU CA . 52655 1 503 . 1 . 1 122 122 LEU CB C 13 41.67 0.02 . . . . . . . 122 LEU CB . 52655 1 504 . 1 . 1 122 122 LEU N N 15 125.28 0.04 . . . . . . . 122 LEU N . 52655 1 505 . 1 . 1 123 123 PRO C C 13 176.62 0.02 . . . . . . . 123 PRO C . 52655 1 506 . 1 . 1 123 123 PRO CA C 13 62.78 0.02 . . . . . . . 123 PRO CA . 52655 1 507 . 1 . 1 123 123 PRO CB C 13 31.87 0.02 . . . . . . . 123 PRO CB . 52655 1 508 . 1 . 1 123 123 PRO N N 15 136.13 0.04 . . . . . . . 123 PRO N . 52655 1 509 . 1 . 1 124 124 SER H H 1 8.42 0.01 . . . . . . . 124 SER HN . 52655 1 510 . 1 . 1 124 124 SER C C 13 173.11 0.02 . . . . . . . 124 SER C . 52655 1 511 . 1 . 1 124 124 SER CA C 13 56.09 0.02 . . . . . . . 124 SER CA . 52655 1 512 . 1 . 1 124 124 SER CB C 13 63.20 0.02 . . . . . . . 124 SER CB . 52655 1 513 . 1 . 1 124 124 SER N N 15 117.57 0.04 . . . . . . . 124 SER N . 52655 1 514 . 1 . 1 125 125 PRO C C 13 177.14 0.02 . . . . . . . 125 PRO C . 52655 1 515 . 1 . 1 125 125 PRO CA C 13 63.23 0.02 . . . . . . . 125 PRO CA . 52655 1 516 . 1 . 1 125 125 PRO CB C 13 31.88 0.02 . . . . . . . 125 PRO CB . 52655 1 517 . 1 . 1 125 125 PRO N N 15 138.06 0.04 . . . . . . . 125 PRO N . 52655 1 518 . 1 . 1 126 126 THR H H 1 8.18 0.01 . . . . . . . 126 THR HN . 52655 1 519 . 1 . 1 126 126 THR C C 13 174.49 0.02 . . . . . . . 126 THR C . 52655 1 520 . 1 . 1 126 126 THR CA C 13 61.59 0.02 . . . . . . . 126 THR CA . 52655 1 521 . 1 . 1 126 126 THR CB C 13 69.62 0.02 . . . . . . . 126 THR CB . 52655 1 522 . 1 . 1 126 126 THR N N 15 113.33 0.04 . . . . . . . 126 THR N . 52655 1 523 . 1 . 1 127 127 SER H H 1 8.17 0.01 . . . . . . . 127 SER HN . 52655 1 524 . 1 . 1 127 127 SER C C 13 173.50 0.02 . . . . . . . 127 SER C . 52655 1 525 . 1 . 1 127 127 SER CA C 13 57.95 0.02 . . . . . . . 127 SER CA . 52655 1 526 . 1 . 1 127 127 SER CB C 13 63.92 0.02 . . . . . . . 127 SER CB . 52655 1 527 . 1 . 1 127 127 SER N N 15 117.99 0.04 . . . . . . . 127 SER N . 52655 1 528 . 1 . 1 128 128 ALA H H 1 8.27 0.01 . . . . . . . 128 ALA HN . 52655 1 529 . 1 . 1 128 128 ALA C C 13 174.88 0.02 . . . . . . . 128 ALA C . 52655 1 530 . 1 . 1 128 128 ALA CA C 13 50.39 0.02 . . . . . . . 128 ALA CA . 52655 1 531 . 1 . 1 128 128 ALA CB C 13 18.13 0.02 . . . . . . . 128 ALA CB . 52655 1 532 . 1 . 1 128 128 ALA N N 15 126.99 0.04 . . . . . . . 128 ALA N . 52655 1 533 . 1 . 1 129 129 PRO C C 13 174.85 0.02 . . . . . . . 129 PRO C . 52655 1 534 . 1 . 1 129 129 PRO N N 15 137.26 0.04 . . . . . . . 129 PRO N . 52655 1 535 . 1 . 1 130 130 PRO C C 13 177.44 0.02 . . . . . . . 130 PRO C . 52655 1 536 . 1 . 1 130 130 PRO CA C 13 63.15 0.02 . . . . . . . 130 PRO CA . 52655 1 537 . 1 . 1 130 130 PRO CB C 13 31.87 0.02 . . . . . . . 130 PRO CB . 52655 1 538 . 1 . 1 130 130 PRO N N 15 135.84 0.04 . . . . . . . 130 PRO N . 52655 1 539 . 1 . 1 131 131 GLY H H 1 8.49 0.01 . . . . . . . 131 GLY HN . 52655 1 540 . 1 . 1 131 131 GLY C C 13 174.00 0.02 . . . . . . . 131 GLY C . 52655 1 541 . 1 . 1 131 131 GLY CA C 13 44.91 0.02 . . . . . . . 131 GLY CA . 52655 1 542 . 1 . 1 131 131 GLY N N 15 109.36 0.04 . . . . . . . 131 GLY N . 52655 1 543 . 1 . 1 132 132 THR H H 1 8.00 0.01 . . . . . . . 132 THR HN . 52655 1 544 . 1 . 1 132 132 THR C C 13 172.93 0.02 . . . . . . . 132 THR C . 52655 1 545 . 1 . 1 132 132 THR CA C 13 59.98 0.02 . . . . . . . 132 THR CA . 52655 1 546 . 1 . 1 132 132 THR CB C 13 69.64 0.02 . . . . . . . 132 THR CB . 52655 1 547 . 1 . 1 132 132 THR N N 15 116.65 0.04 . . . . . . . 132 THR N . 52655 1 548 . 1 . 1 133 133 PRO C C 13 177.02 0.02 . . . . . . . 133 PRO C . 52655 1 549 . 1 . 1 133 133 PRO CA C 13 63.24 0.02 . . . . . . . 133 PRO CA . 52655 1 550 . 1 . 1 133 133 PRO CB C 13 31.88 0.02 . . . . . . . 133 PRO CB . 52655 1 551 . 1 . 1 133 133 PRO N N 15 139.42 0.04 . . . . . . . 133 PRO N . 52655 1 552 . 1 . 1 134 134 THR H H 1 8.25 0.01 . . . . . . . 134 THR HN . 52655 1 553 . 1 . 1 134 134 THR C C 13 174.41 0.02 . . . . . . . 134 THR C . 52655 1 554 . 1 . 1 134 134 THR CA C 13 61.84 0.02 . . . . . . . 134 THR CA . 52655 1 555 . 1 . 1 134 134 THR CB C 13 69.67 0.02 . . . . . . . 134 THR CB . 52655 1 556 . 1 . 1 134 134 THR N N 15 114.80 0.04 . . . . . . . 134 THR N . 52655 1 557 . 1 . 1 135 135 GLN H H 1 8.36 0.01 . . . . . . . 135 GLN HN . 52655 1 558 . 1 . 1 135 135 GLN C C 13 175.46 0.02 . . . . . . . 135 GLN C . 52655 1 559 . 1 . 1 135 135 GLN CA C 13 55.43 0.02 . . . . . . . 135 GLN CA . 52655 1 560 . 1 . 1 135 135 GLN CB C 13 29.40 0.02 . . . . . . . 135 GLN CB . 52655 1 561 . 1 . 1 135 135 GLN N N 15 122.78 0.04 . . . . . . . 135 GLN N . 52655 1 562 . 1 . 1 136 136 GLN H H 1 8.50 0.01 . . . . . . . 136 GLN HN . 52655 1 563 . 1 . 1 136 136 GLN C C 13 173.94 0.02 . . . . . . . 136 GLN C . 52655 1 564 . 1 . 1 136 136 GLN CA C 13 53.52 0.02 . . . . . . . 136 GLN CA . 52655 1 565 . 1 . 1 136 136 GLN CB C 13 28.74 0.02 . . . . . . . 136 GLN CB . 52655 1 566 . 1 . 1 136 136 GLN N N 15 123.32 0.04 . . . . . . . 136 GLN N . 52655 1 567 . 1 . 1 137 137 PRO C C 13 176.76 0.02 . . . . . . . 137 PRO C . 52655 1 568 . 1 . 1 137 137 PRO CA C 13 62.81 0.02 . . . . . . . 137 PRO CA . 52655 1 569 . 1 . 1 137 137 PRO CB C 13 31.89 0.02 . . . . . . . 137 PRO CB . 52655 1 570 . 1 . 1 137 137 PRO N N 15 137.35 0.04 . . . . . . . 137 PRO N . 52655 1 571 . 1 . 1 138 138 SER H H 1 8.48 0.01 . . . . . . . 138 SER HN . 52655 1 572 . 1 . 1 138 138 SER C C 13 174.29 0.02 . . . . . . . 138 SER C . 52655 1 573 . 1 . 1 138 138 SER CA C 13 58.06 0.02 . . . . . . . 138 SER CA . 52655 1 574 . 1 . 1 138 138 SER CB C 13 63.67 0.02 . . . . . . . 138 SER CB . 52655 1 575 . 1 . 1 138 138 SER N N 15 116.42 0.04 . . . . . . . 138 SER N . 52655 1 576 . 1 . 1 139 139 THR H H 1 8.16 0.01 . . . . . . . 139 THR HN . 52655 1 577 . 1 . 1 139 139 THR C C 13 172.80 0.02 . . . . . . . 139 THR C . 52655 1 578 . 1 . 1 139 139 THR CA C 13 59.50 0.02 . . . . . . . 139 THR CA . 52655 1 579 . 1 . 1 139 139 THR CB C 13 69.66 0.02 . . . . . . . 139 THR CB . 52655 1 580 . 1 . 1 139 139 THR N N 15 117.99 0.04 . . . . . . . 139 THR N . 52655 1 581 . 1 . 1 140 140 PRO C C 13 176.80 0.02 . . . . . . . 140 PRO C . 52655 1 582 . 1 . 1 140 140 PRO CA C 13 63.15 0.02 . . . . . . . 140 PRO CA . 52655 1 583 . 1 . 1 140 140 PRO CB C 13 31.88 0.02 . . . . . . . 140 PRO CB . 52655 1 584 . 1 . 1 140 140 PRO N N 15 138.76 0.04 . . . . . . . 140 PRO N . 52655 1 585 . 1 . 1 141 141 GLN H H 1 8.52 0.01 . . . . . . . 141 GLN HN . 52655 1 586 . 1 . 1 141 141 GLN C C 13 175.93 0.02 . . . . . . . 141 GLN C . 52655 1 587 . 1 . 1 141 141 GLN CA C 13 55.41 0.02 . . . . . . . 141 GLN CA . 52655 1 588 . 1 . 1 141 141 GLN CB C 13 29.44 0.02 . . . . . . . 141 GLN CB . 52655 1 589 . 1 . 1 141 141 GLN N N 15 120.84 0.04 . . . . . . . 141 GLN N . 52655 1 590 . 1 . 1 142 142 THR H H 1 8.23 0.01 . . . . . . . 142 THR HN . 52655 1 591 . 1 . 1 142 142 THR C C 13 172.63 0.02 . . . . . . . 142 THR C . 52655 1 592 . 1 . 1 142 142 THR CA C 13 59.73 0.02 . . . . . . . 142 THR CA . 52655 1 593 . 1 . 1 142 142 THR CB C 13 69.66 0.02 . . . . . . . 142 THR CB . 52655 1 594 . 1 . 1 142 142 THR N N 15 118.25 0.04 . . . . . . . 142 THR N . 52655 1 595 . 1 . 1 143 143 PRO C C 13 176.60 0.02 . . . . . . . 143 PRO C . 52655 1 596 . 1 . 1 143 143 PRO CA C 13 63.06 0.02 . . . . . . . 143 PRO CA . 52655 1 597 . 1 . 1 143 143 PRO CB C 13 31.87 0.02 . . . . . . . 143 PRO CB . 52655 1 598 . 1 . 1 143 143 PRO N N 15 138.99 0.04 . . . . . . . 143 PRO N . 52655 1 599 . 1 . 1 144 144 GLN H H 1 8.47 0.01 . . . . . . . 144 GLN HN . 52655 1 600 . 1 . 1 144 144 GLN C C 13 173.59 0.02 . . . . . . . 144 GLN C . 52655 1 601 . 1 . 1 144 144 GLN CA C 13 53.01 0.02 . . . . . . . 144 GLN CA . 52655 1 602 . 1 . 1 144 144 GLN CB C 13 28.95 0.02 . . . . . . . 144 GLN CB . 52655 1 603 . 1 . 1 144 144 GLN N N 15 122.18 0.04 . . . . . . . 144 GLN N . 52655 1 604 . 1 . 1 145 145 PRO C C 13 174.50 0.02 . . . . . . . 145 PRO C . 52655 1 605 . 1 . 1 145 145 PRO N N 15 138.88 0.04 . . . . . . . 145 PRO N . 52655 1 606 . 1 . 1 146 146 PRO C C 13 176.51 0.02 . . . . . . . 146 PRO C . 52655 1 607 . 1 . 1 146 146 PRO CA C 13 62.74 0.02 . . . . . . . 146 PRO CA . 52655 1 608 . 1 . 1 146 146 PRO CB C 13 31.80 0.02 . . . . . . . 146 PRO CB . 52655 1 609 . 1 . 1 146 146 PRO N N 15 135.39 0.04 . . . . . . . 146 PRO N . 52655 1 610 . 1 . 1 147 147 ALA H H 1 8.36 0.01 . . . . . . . 147 ALA HN . 52655 1 611 . 1 . 1 147 147 ALA C C 13 177.49 0.02 . . . . . . . 147 ALA C . 52655 1 612 . 1 . 1 147 147 ALA CA C 13 52.08 0.02 . . . . . . . 147 ALA CA . 52655 1 613 . 1 . 1 147 147 ALA CB C 13 19.03 0.02 . . . . . . . 147 ALA CB . 52655 1 614 . 1 . 1 147 147 ALA N N 15 124.32 0.04 . . . . . . . 147 ALA N . 52655 1 615 . 1 . 1 148 148 GLN H H 1 8.33 0.01 . . . . . . . 148 GLN HN . 52655 1 616 . 1 . 1 148 148 GLN C C 13 173.90 0.02 . . . . . . . 148 GLN C . 52655 1 617 . 1 . 1 148 148 GLN CA C 13 53.34 0.02 . . . . . . . 148 GLN CA . 52655 1 618 . 1 . 1 148 148 GLN CB C 13 29.75 0.02 . . . . . . . 148 GLN CB . 52655 1 619 . 1 . 1 148 148 GLN N N 15 120.55 0.04 . . . . . . . 148 GLN N . 52655 1 620 . 1 . 1 149 149 PRO C C 13 176.56 0.02 . . . . . . . 149 PRO C . 52655 1 621 . 1 . 1 149 149 PRO CA C 13 62.89 0.02 . . . . . . . 149 PRO CA . 52655 1 622 . 1 . 1 149 149 PRO CB C 13 31.97 0.02 . . . . . . . 149 PRO CB . 52655 1 623 . 1 . 1 149 149 PRO N N 15 137.18 0.04 . . . . . . . 149 PRO N . 52655 1 624 . 1 . 1 150 150 GLN H H 1 8.49 0.01 . . . . . . . 150 GLN HN . 52655 1 625 . 1 . 1 150 150 GLN C C 13 173.97 0.02 . . . . . . . 150 GLN C . 52655 1 626 . 1 . 1 150 150 GLN CA C 13 53.38 0.02 . . . . . . . 150 GLN CA . 52655 1 627 . 1 . 1 150 150 GLN CB C 13 28.87 0.02 . . . . . . . 150 GLN CB . 52655 1 628 . 1 . 1 150 150 GLN N N 15 121.66 0.04 . . . . . . . 150 GLN N . 52655 1 629 . 1 . 1 151 151 PRO C C 13 176.59 0.02 . . . . . . . 151 PRO C . 52655 1 630 . 1 . 1 151 151 PRO CA C 13 62.81 0.02 . . . . . . . 151 PRO CA . 52655 1 631 . 1 . 1 151 151 PRO CB C 13 31.89 0.02 . . . . . . . 151 PRO CB . 52655 1 632 . 1 . 1 151 151 PRO N N 15 137.17 0.04 . . . . . . . 151 PRO N . 52655 1 633 . 1 . 1 152 152 SER H H 1 8.44 0.01 . . . . . . . 152 SER HN . 52655 1 634 . 1 . 1 152 152 SER C C 13 172.86 0.02 . . . . . . . 152 SER C . 52655 1 635 . 1 . 1 152 152 SER CA C 13 56.24 0.02 . . . . . . . 152 SER CA . 52655 1 636 . 1 . 1 152 152 SER CB C 13 63.20 0.02 . . . . . . . 152 SER CB . 52655 1 637 . 1 . 1 152 152 SER N N 15 117.81 0.04 . . . . . . . 152 SER N . 52655 1 638 . 1 . 1 153 153 PRO C C 13 176.93 0.02 . . . . . . . 153 PRO C . 52655 1 639 . 1 . 1 153 153 PRO CA C 13 63.20 0.02 . . . . . . . 153 PRO CA . 52655 1 640 . 1 . 1 153 153 PRO CB C 13 31.86 0.02 . . . . . . . 153 PRO CB . 52655 1 641 . 1 . 1 153 153 PRO N N 15 137.98 0.04 . . . . . . . 153 PRO N . 52655 1 642 . 1 . 1 154 154 VAL H H 1 8.15 0.01 . . . . . . . 154 VAL HN . 52655 1 643 . 1 . 1 154 154 VAL C C 13 176.16 0.02 . . . . . . . 154 VAL C . 52655 1 644 . 1 . 1 154 154 VAL CA C 13 62.17 0.02 . . . . . . . 154 VAL CA . 52655 1 645 . 1 . 1 154 154 VAL CB C 13 32.54 0.02 . . . . . . . 154 VAL CB . 52655 1 646 . 1 . 1 154 154 VAL N N 15 119.81 0.04 . . . . . . . 154 VAL N . 52655 1 647 . 1 . 1 155 155 SER H H 1 8.30 0.01 . . . . . . . 155 SER HN . 52655 1 648 . 1 . 1 155 155 SER C C 13 174.29 0.02 . . . . . . . 155 SER C . 52655 1 649 . 1 . 1 155 155 SER CA C 13 57.94 0.02 . . . . . . . 155 SER CA . 52655 1 650 . 1 . 1 155 155 SER CB C 13 63.69 0.02 . . . . . . . 155 SER CB . 52655 1 651 . 1 . 1 155 155 SER N N 15 119.08 0.04 . . . . . . . 155 SER N . 52655 1 652 . 1 . 1 156 156 MET H H 1 8.38 0.01 . . . . . . . 156 MET HN . 52655 1 653 . 1 . 1 156 156 MET C C 13 175.86 0.02 . . . . . . . 156 MET C . 52655 1 654 . 1 . 1 156 156 MET CA C 13 54.93 0.02 . . . . . . . 156 MET CA . 52655 1 655 . 1 . 1 156 156 MET CB C 13 32.82 0.02 . . . . . . . 156 MET CB . 52655 1 656 . 1 . 1 156 156 MET N N 15 122.65 0.04 . . . . . . . 156 MET N . 52655 1 657 . 1 . 1 157 157 SER H H 1 8.35 0.01 . . . . . . . 157 SER HN . 52655 1 658 . 1 . 1 157 157 SER C C 13 172.77 0.02 . . . . . . . 157 SER C . 52655 1 659 . 1 . 1 157 157 SER CA C 13 56.23 0.02 . . . . . . . 157 SER CA . 52655 1 660 . 1 . 1 157 157 SER CB C 13 63.13 0.02 . . . . . . . 157 SER CB . 52655 1 661 . 1 . 1 157 157 SER N N 15 118.54 0.04 . . . . . . . 157 SER N . 52655 1 662 . 1 . 1 158 158 PRO C C 13 176.67 0.02 . . . . . . . 158 PRO C . 52655 1 663 . 1 . 1 158 158 PRO CA C 13 63.31 0.02 . . . . . . . 158 PRO CA . 52655 1 664 . 1 . 1 158 158 PRO CB C 13 31.63 0.02 . . . . . . . 158 PRO CB . 52655 1 665 . 1 . 1 158 158 PRO N N 15 138.21 0.04 . . . . . . . 158 PRO N . 52655 1 666 . 1 . 1 159 159 ALA H H 1 8.25 0.01 . . . . . . . 159 ALA HN . 52655 1 667 . 1 . 1 159 159 ALA C C 13 178.03 0.02 . . . . . . . 159 ALA C . 52655 1 668 . 1 . 1 159 159 ALA CA C 13 52.42 0.02 . . . . . . . 159 ALA CA . 52655 1 669 . 1 . 1 159 159 ALA CB C 13 18.92 0.02 . . . . . . . 159 ALA CB . 52655 1 670 . 1 . 1 159 159 ALA N N 15 123.44 0.04 . . . . . . . 159 ALA N . 52655 1 671 . 1 . 1 160 160 GLY H H 1 8.19 0.01 . . . . . . . 160 GLY HN . 52655 1 672 . 1 . 1 160 160 GLY C C 13 173.35 0.02 . . . . . . . 160 GLY C . 52655 1 673 . 1 . 1 160 160 GLY CA C 13 44.79 0.02 . . . . . . . 160 GLY CA . 52655 1 674 . 1 . 1 160 160 GLY N N 15 107.39 0.04 . . . . . . . 160 GLY N . 52655 1 675 . 1 . 1 161 161 PHE H H 1 7.98 0.01 . . . . . . . 161 PHE HN . 52655 1 676 . 1 . 1 161 161 PHE C C 13 173.91 0.02 . . . . . . . 161 PHE C . 52655 1 677 . 1 . 1 161 161 PHE CA C 13 55.50 0.02 . . . . . . . 161 PHE CA . 52655 1 678 . 1 . 1 161 161 PHE CB C 13 38.88 0.02 . . . . . . . 161 PHE CB . 52655 1 679 . 1 . 1 161 161 PHE N N 15 120.71 0.04 . . . . . . . 161 PHE N . 52655 1 680 . 1 . 1 162 162 PRO C C 13 176.71 0.02 . . . . . . . 162 PRO C . 52655 1 681 . 1 . 1 162 162 PRO CA C 13 63.07 0.02 . . . . . . . 162 PRO CA . 52655 1 682 . 1 . 1 162 162 PRO CB C 13 31.88 0.02 . . . . . . . 162 PRO CB . 52655 1 683 . 1 . 1 162 162 PRO N N 15 137.31 0.04 . . . . . . . 162 PRO N . 52655 1 684 . 1 . 1 163 163 SER H H 1 8.38 0.01 . . . . . . . 163 SER HN . 52655 1 685 . 1 . 1 163 163 SER C C 13 174.64 0.02 . . . . . . . 163 SER C . 52655 1 686 . 1 . 1 163 163 SER CA C 13 58.18 0.02 . . . . . . . 163 SER CA . 52655 1 687 . 1 . 1 163 163 SER CB C 13 63.59 0.02 . . . . . . . 163 SER CB . 52655 1 688 . 1 . 1 163 163 SER N N 15 116.42 0.04 . . . . . . . 163 SER N . 52655 1 689 . 1 . 1 164 164 VAL H H 1 8.12 0.01 . . . . . . . 164 VAL HN . 52655 1 690 . 1 . 1 164 164 VAL C C 13 175.69 0.02 . . . . . . . 164 VAL C . 52655 1 691 . 1 . 1 164 164 VAL CA C 13 61.91 0.02 . . . . . . . 164 VAL CA . 52655 1 692 . 1 . 1 164 164 VAL CB C 13 32.75 0.02 . . . . . . . 164 VAL CB . 52655 1 693 . 1 . 1 164 164 VAL N N 15 121.65 0.04 . . . . . . . 164 VAL N . 52655 1 694 . 1 . 1 165 165 ALA H H 1 8.34 0.01 . . . . . . . 165 ALA HN . 52655 1 695 . 1 . 1 165 165 ALA C C 13 177.51 0.02 . . . . . . . 165 ALA C . 52655 1 696 . 1 . 1 165 165 ALA CA C 13 52.16 0.02 . . . . . . . 165 ALA CA . 52655 1 697 . 1 . 1 165 165 ALA CB C 13 19.07 0.02 . . . . . . . 165 ALA CB . 52655 1 698 . 1 . 1 165 165 ALA N N 15 127.65 0.04 . . . . . . . 165 ALA N . 52655 1 699 . 1 . 1 166 166 ARG H H 1 8.34 0.01 . . . . . . . 166 ARG HN . 52655 1 700 . 1 . 1 166 166 ARG C C 13 176.39 0.02 . . . . . . . 166 ARG C . 52655 1 701 . 1 . 1 166 166 ARG CA C 13 55.88 0.02 . . . . . . . 166 ARG CA . 52655 1 702 . 1 . 1 166 166 ARG CB C 13 30.67 0.02 . . . . . . . 166 ARG CB . 52655 1 703 . 1 . 1 166 166 ARG N N 15 120.68 0.04 . . . . . . . 166 ARG N . 52655 1 704 . 1 . 1 167 167 THR H H 1 8.16 0.01 . . . . . . . 167 THR HN . 52655 1 705 . 1 . 1 167 167 THR C C 13 174.10 0.02 . . . . . . . 167 THR C . 52655 1 706 . 1 . 1 167 167 THR CA C 13 61.52 0.02 . . . . . . . 167 THR CA . 52655 1 707 . 1 . 1 167 167 THR CB C 13 69.75 0.02 . . . . . . . 167 THR CB . 52655 1 708 . 1 . 1 167 167 THR N N 15 115.64 0.04 . . . . . . . 167 THR N . 52655 1 709 . 1 . 1 168 168 GLN H H 1 8.41 0.01 . . . . . . . 168 GLN HN . 52655 1 710 . 1 . 1 168 168 GLN C C 13 173.36 0.02 . . . . . . . 168 GLN C . 52655 1 711 . 1 . 1 168 168 GLN CA C 13 53.38 0.02 . . . . . . . 168 GLN CA . 52655 1 712 . 1 . 1 168 168 GLN CB C 13 28.99 0.02 . . . . . . . 168 GLN CB . 52655 1 713 . 1 . 1 168 168 GLN N N 15 124.02 0.04 . . . . . . . 168 GLN N . 52655 1 714 . 1 . 1 169 169 PRO C C 13 174.64 0.02 . . . . . . . 169 PRO C . 52655 1 715 . 1 . 1 169 169 PRO N N 15 138.80 0.04 . . . . . . . 169 PRO N . 52655 1 716 . 1 . 1 170 170 PRO C C 13 176.99 0.02 . . . . . . . 170 PRO C . 52655 1 717 . 1 . 1 170 170 PRO CA C 13 62.84 0.02 . . . . . . . 170 PRO CA . 52655 1 718 . 1 . 1 170 170 PRO CB C 13 31.92 0.02 . . . . . . . 170 PRO CB . 52655 1 719 . 1 . 1 170 170 PRO N N 15 135.27 0.04 . . . . . . . 170 PRO N . 52655 1 720 . 1 . 1 171 171 THR H H 1 8.26 0.01 . . . . . . . 171 THR HN . 52655 1 721 . 1 . 1 171 171 THR C C 13 174.67 0.02 . . . . . . . 171 THR C . 52655 1 722 . 1 . 1 171 171 THR CA C 13 61.72 0.02 . . . . . . . 171 THR CA . 52655 1 723 . 1 . 1 171 171 THR CB C 13 69.69 0.02 . . . . . . . 171 THR CB . 52655 1 724 . 1 . 1 171 171 THR N N 15 114.37 0.04 . . . . . . . 171 THR N . 52655 1 725 . 1 . 1 172 172 THR H H 1 8.17 0.01 . . . . . . . 172 THR HN . 52655 1 726 . 1 . 1 172 172 THR C C 13 174.33 0.02 . . . . . . . 172 THR C . 52655 1 727 . 1 . 1 172 172 THR CA C 13 61.60 0.02 . . . . . . . 172 THR CA . 52655 1 728 . 1 . 1 172 172 THR CB C 13 69.83 0.02 . . . . . . . 172 THR CB . 52655 1 729 . 1 . 1 172 172 THR N N 15 116.81 0.04 . . . . . . . 172 THR N . 52655 1 730 . 1 . 1 173 173 VAL H H 1 8.20 0.01 . . . . . . . 173 VAL HN . 52655 1 731 . 1 . 1 173 173 VAL C C 13 176.10 0.02 . . . . . . . 173 VAL C . 52655 1 732 . 1 . 1 173 173 VAL CA C 13 62.01 0.02 . . . . . . . 173 VAL CA . 52655 1 733 . 1 . 1 173 173 VAL CB C 13 32.61 0.02 . . . . . . . 173 VAL CB . 52655 1 734 . 1 . 1 173 173 VAL N N 15 122.62 0.04 . . . . . . . 173 VAL N . 52655 1 735 . 1 . 1 174 174 SER H H 1 8.48 0.01 . . . . . . . 174 SER HN . 52655 1 736 . 1 . 1 174 174 SER C C 13 174.83 0.02 . . . . . . . 174 SER C . 52655 1 737 . 1 . 1 174 174 SER CA C 13 57.96 0.02 . . . . . . . 174 SER CA . 52655 1 738 . 1 . 1 174 174 SER CB C 13 63.68 0.02 . . . . . . . 174 SER CB . 52655 1 739 . 1 . 1 174 174 SER N N 15 119.85 0.04 . . . . . . . 174 SER N . 52655 1 740 . 1 . 1 175 175 THR H H 1 8.22 0.01 . . . . . . . 175 THR HN . 52655 1 741 . 1 . 1 175 175 THR C C 13 175.05 0.02 . . . . . . . 175 THR C . 52655 1 742 . 1 . 1 175 175 THR CA C 13 61.75 0.02 . . . . . . . 175 THR CA . 52655 1 743 . 1 . 1 175 175 THR CB C 13 69.62 0.02 . . . . . . . 175 THR CB . 52655 1 744 . 1 . 1 175 175 THR N N 15 115.75 0.04 . . . . . . . 175 THR N . 52655 1 745 . 1 . 1 176 176 GLY H H 1 8.38 0.01 . . . . . . . 176 GLY HN . 52655 1 746 . 1 . 1 176 176 GLY C C 13 173.57 0.02 . . . . . . . 176 GLY C . 52655 1 747 . 1 . 1 176 176 GLY CA C 13 45.07 0.02 . . . . . . . 176 GLY CA . 52655 1 748 . 1 . 1 176 176 GLY N N 15 110.92 0.04 . . . . . . . 176 GLY N . 52655 1 749 . 1 . 1 177 177 LYS H H 1 8.14 0.01 . . . . . . . 177 LYS HN . 52655 1 750 . 1 . 1 177 177 LYS C C 13 174.58 0.02 . . . . . . . 177 LYS C . 52655 1 751 . 1 . 1 177 177 LYS CA C 13 53.87 0.02 . . . . . . . 177 LYS CA . 52655 1 752 . 1 . 1 177 177 LYS CB C 13 32.45 0.02 . . . . . . . 177 LYS CB . 52655 1 753 . 1 . 1 177 177 LYS N N 15 121.99 0.04 . . . . . . . 177 LYS N . 52655 1 754 . 1 . 1 178 178 PRO C C 13 177.16 0.02 . . . . . . . 178 PRO C . 52655 1 755 . 1 . 1 178 178 PRO CA C 13 63.09 0.02 . . . . . . . 178 PRO CA . 52655 1 756 . 1 . 1 178 178 PRO CB C 13 31.94 0.02 . . . . . . . 178 PRO CB . 52655 1 757 . 1 . 1 178 178 PRO N N 15 137.35 0.04 . . . . . . . 178 PRO N . 52655 1 758 . 1 . 1 179 179 THR H H 1 8.31 0.01 . . . . . . . 179 THR HN . 52655 1 759 . 1 . 1 179 179 THR C C 13 174.59 0.02 . . . . . . . 179 THR C . 52655 1 760 . 1 . 1 179 179 THR CA C 13 61.7 0.02 . . . . . . . 179 THR CA . 52655 1 761 . 1 . 1 179 179 THR CB C 13 69.63 0.02 . . . . . . . 179 THR CB . 52655 1 762 . 1 . 1 179 179 THR N N 15 114.53 0.04 . . . . . . . 179 THR N . 52655 1 763 . 1 . 1 180 180 SER H H 1 8.26 0.01 . . . . . . . 180 SER HN . 52655 1 764 . 1 . 1 180 180 SER C C 13 174.20 0.02 . . . . . . . 180 SER C . 52655 1 765 . 1 . 1 180 180 SER CA C 13 58.05 0.02 . . . . . . . 180 SER CA . 52655 1 766 . 1 . 1 180 180 SER CB C 13 63.76 0.02 . . . . . . . 180 SER CB . 52655 1 767 . 1 . 1 180 180 SER N N 15 117.68 0.04 . . . . . . . 180 SER N . 52655 1 768 . 1 . 1 181 181 GLN H H 1 8.43 0.01 . . . . . . . 181 GLN HN . 52655 1 769 . 1 . 1 181 181 GLN C C 13 175.57 0.02 . . . . . . . 181 GLN C . 52655 1 770 . 1 . 1 181 181 GLN CA C 13 55.47 0.02 . . . . . . . 181 GLN CA . 52655 1 771 . 1 . 1 181 181 GLN CB C 13 29.35 0.02 . . . . . . . 181 GLN CB . 52655 1 772 . 1 . 1 181 181 GLN N N 15 122.44 0.04 . . . . . . . 181 GLN N . 52655 1 773 . 1 . 1 182 182 VAL H H 1 8.25 0.01 . . . . . . . 182 VAL HN . 52655 1 774 . 1 . 1 182 182 VAL C C 13 174.29 0.02 . . . . . . . 182 VAL C . 52655 1 775 . 1 . 1 182 182 VAL CA C 13 59.75 0.02 . . . . . . . 182 VAL CA . 52655 1 776 . 1 . 1 182 182 VAL CB C 13 32.33 0.02 . . . . . . . 182 VAL CB . 52655 1 777 . 1 . 1 182 182 VAL N N 15 123.17 0.04 . . . . . . . 182 VAL N . 52655 1 778 . 1 . 1 183 183 PRO C C 13 176.04 0.02 . . . . . . . 183 PRO C . 52655 1 779 . 1 . 1 183 183 PRO CA C 13 62.91 0.02 . . . . . . . 183 PRO CA . 52655 1 780 . 1 . 1 183 183 PRO CB C 13 31.98 0.02 . . . . . . . 183 PRO CB . 52655 1 781 . 1 . 1 183 183 PRO N N 15 139.76 0.04 . . . . . . . 183 PRO N . 52655 1 782 . 1 . 1 184 184 ALA H H 1 8.32 0.01 . . . . . . . 184 ALA HN . 52655 1 783 . 1 . 1 184 184 ALA C C 13 175.00 0.02 . . . . . . . 184 ALA C . 52655 1 784 . 1 . 1 184 184 ALA CA C 13 50.07 0.02 . . . . . . . 184 ALA CA . 52655 1 785 . 1 . 1 184 184 ALA CB C 13 17.95 0.02 . . . . . . . 184 ALA CB . 52655 1 786 . 1 . 1 184 184 ALA N N 15 125.72 0.04 . . . . . . . 184 ALA N . 52655 1 787 . 1 . 1 185 185 PRO C C 13 174.19 0.02 . . . . . . . 185 PRO C . 52655 1 788 . 1 . 1 185 185 PRO N N 15 136.85 0.04 . . . . . . . 185 PRO N . 52655 1 789 . 1 . 1 186 186 PRO C C 13 174.16 0.02 . . . . . . . 186 PRO C . 52655 1 790 . 1 . 1 186 186 PRO N N 15 136.56 0.04 . . . . . . . 186 PRO N . 52655 1 791 . 1 . 1 187 187 PRO C C 13 174.59 0.02 . . . . . . . 187 PRO C . 52655 1 792 . 1 . 1 187 187 PRO N N 15 136.23 0.04 . . . . . . . 187 PRO N . 52655 1 793 . 1 . 1 188 188 PRO C C 13 176.58 0.02 . . . . . . . 188 PRO C . 52655 1 794 . 1 . 1 188 188 PRO CA C 13 62.66 0.02 . . . . . . . 188 PRO CA . 52655 1 795 . 1 . 1 188 188 PRO CB C 13 31.88 0.02 . . . . . . . 188 PRO CB . 52655 1 796 . 1 . 1 188 188 PRO N N 15 135.07 0.04 . . . . . . . 188 PRO N . 52655 1 797 . 1 . 1 189 189 ALA H H 1 8.35 0.01 . . . . . . . 189 ALA HN . 52655 1 798 . 1 . 1 189 189 ALA C C 13 177.49 0.02 . . . . . . . 189 ALA C . 52655 1 799 . 1 . 1 189 189 ALA CA C 13 52.19 0.02 . . . . . . . 189 ALA CA . 52655 1 800 . 1 . 1 189 189 ALA CB C 13 19.09 0.02 . . . . . . . 189 ALA CB . 52655 1 801 . 1 . 1 189 189 ALA N N 15 124.32 0.04 . . . . . . . 189 ALA N . 52655 1 802 . 1 . 1 190 190 GLN H H 1 8.30 0.01 . . . . . . . 190 GLN HN . 52655 1 803 . 1 . 1 190 190 GLN C C 13 173.44 0.02 . . . . . . . 190 GLN C . 52655 1 804 . 1 . 1 190 190 GLN CA C 13 53.19 0.02 . . . . . . . 190 GLN CA . 52655 1 805 . 1 . 1 190 190 GLN CB C 13 28.94 0.02 . . . . . . . 190 GLN CB . 52655 1 806 . 1 . 1 190 190 GLN N N 15 120.55 0.04 . . . . . . . 190 GLN N . 52655 1 807 . 1 . 1 191 191 PRO C C 13 174.00 0.02 . . . . . . . 191 PRO C . 52655 1 808 . 1 . 1 191 191 PRO N N 15 138.77 0.04 . . . . . . . 191 PRO N . 52655 1 809 . 1 . 1 192 192 PRO C C 13 174.63 0.02 . . . . . . . 192 PRO C . 52655 1 810 . 1 . 1 192 192 PRO N N 15 136.31 0.04 . . . . . . . 192 PRO N . 52655 1 811 . 1 . 1 193 193 PRO C C 13 177.03 0.02 . . . . . . . 193 PRO C . 52655 1 812 . 1 . 1 193 193 PRO CA C 13 63.21 0.02 . . . . . . . 193 PRO CA . 52655 1 813 . 1 . 1 193 193 PRO CB C 13 31.79 0.02 . . . . . . . 193 PRO CB . 52655 1 814 . 1 . 1 193 193 PRO N N 15 135.11 0.04 . . . . . . . 193 PRO N . 52655 1 815 . 1 . 1 194 194 ALA H H 1 8.41 0.01 . . . . . . . 194 ALA HN . 52655 1 816 . 1 . 1 194 194 ALA C C 13 178.15 0.02 . . . . . . . 194 ALA C . 52655 1 817 . 1 . 1 194 194 ALA CA C 13 52.81 0.02 . . . . . . . 194 ALA CA . 52655 1 818 . 1 . 1 194 194 ALA CB C 13 18.87 0.02 . . . . . . . 194 ALA CB . 52655 1 819 . 1 . 1 194 194 ALA N N 15 123.43 0.04 . . . . . . . 194 ALA N . 52655 1 820 . 1 . 1 195 195 ALA H H 1 8.23 0.01 . . . . . . . 195 ALA HN . 52655 1 821 . 1 . 1 195 195 ALA C C 13 178.53 0.02 . . . . . . . 195 ALA C . 52655 1 822 . 1 . 1 195 195 ALA CA C 13 52.97 0.02 . . . . . . . 195 ALA CA . 52655 1 823 . 1 . 1 195 195 ALA CB C 13 18.77 0.02 . . . . . . . 195 ALA CB . 52655 1 824 . 1 . 1 195 195 ALA N N 15 122.67 0.04 . . . . . . . 195 ALA N . 52655 1 825 . 1 . 1 196 196 VAL H H 1 7.97 0.01 . . . . . . . 196 VAL HN . 52655 1 826 . 1 . 1 196 196 VAL C C 13 176.88 0.02 . . . . . . . 196 VAL C . 52655 1 827 . 1 . 1 196 196 VAL CA C 13 63.15 0.02 . . . . . . . 196 VAL CA . 52655 1 828 . 1 . 1 196 196 VAL CB C 13 32.29 0.02 . . . . . . . 196 VAL CB . 52655 1 829 . 1 . 1 196 196 VAL N N 15 119.58 0.04 . . . . . . . 196 VAL N . 52655 1 830 . 1 . 1 197 197 GLU H H 1 8.34 0.01 . . . . . . . 197 GLU HN . 52655 1 831 . 1 . 1 197 197 GLU C C 13 177.14 0.02 . . . . . . . 197 GLU C . 52655 1 832 . 1 . 1 197 197 GLU CA C 13 57.25 0.02 . . . . . . . 197 GLU CA . 52655 1 833 . 1 . 1 197 197 GLU CB C 13 29.73 0.02 . . . . . . . 197 GLU CB . 52655 1 834 . 1 . 1 197 197 GLU N N 15 123.26 0.04 . . . . . . . 197 GLU N . 52655 1 835 . 1 . 1 198 198 ALA H H 1 8.22 0.01 . . . . . . . 198 ALA HN . 52655 1 836 . 1 . 1 198 198 ALA C C 13 178.47 0.02 . . . . . . . 198 ALA C . 52655 1 837 . 1 . 1 198 198 ALA CA C 13 53.41 0.02 . . . . . . . 198 ALA CA . 52655 1 838 . 1 . 1 198 198 ALA CB C 13 18.55 0.02 . . . . . . . 198 ALA CB . 52655 1 839 . 1 . 1 198 198 ALA N N 15 124.28 0.04 . . . . . . . 198 ALA N . 52655 1 840 . 1 . 1 199 199 ALA H H 1 8.07 0.01 . . . . . . . 199 ALA HN . 52655 1 841 . 1 . 1 199 199 ALA C C 13 178.73 0.02 . . . . . . . 199 ALA C . 52655 1 842 . 1 . 1 199 199 ALA CA C 13 53.26 0.02 . . . . . . . 199 ALA CA . 52655 1 843 . 1 . 1 199 199 ALA CB C 13 18.50 0.02 . . . . . . . 199 ALA CB . 52655 1 844 . 1 . 1 199 199 ALA N N 15 121.68 0.04 . . . . . . . 199 ALA N . 52655 1 845 . 1 . 1 200 200 ARG H H 1 8.11 0.01 . . . . . . . 200 ARG HN . 52655 1 846 . 1 . 1 200 200 ARG C C 13 177.22 0.02 . . . . . . . 200 ARG C . 52655 1 847 . 1 . 1 200 200 ARG CA C 13 56.99 0.02 . . . . . . . 200 ARG CA . 52655 1 848 . 1 . 1 200 200 ARG CB C 13 30.49 0.02 . . . . . . . 200 ARG CB . 52655 1 849 . 1 . 1 200 200 ARG N N 15 119.32 0.04 . . . . . . . 200 ARG N . 52655 1 850 . 1 . 1 201 201 GLN C C 13 176.72 0.02 . . . . . . . 201 GLN C . 52655 1 851 . 1 . 1 201 201 GLN CA C 13 56.83 0.02 . . . . . . . 201 GLN CA . 52655 1 852 . 1 . 1 201 201 GLN CB C 13 28.49 0.02 . . . . . . . 201 GLN CB . 52655 1 853 . 1 . 1 202 202 ILE H H 1 8.03 0.01 . . . . . . . 202 ILE HN . 52655 1 854 . 1 . 1 202 202 ILE C C 13 177.18 0.02 . . . . . . . 202 ILE C . 52655 1 855 . 1 . 1 202 202 ILE CA C 13 62.41 0.02 . . . . . . . 202 ILE CA . 52655 1 856 . 1 . 1 202 202 ILE CB C 13 38.29 0.02 . . . . . . . 202 ILE CB . 52655 1 857 . 1 . 1 202 202 ILE N N 15 121.29 0.04 . . . . . . . 202 ILE N . 52655 1 858 . 1 . 1 203 203 GLU H H 1 8.21 0.01 . . . . . . . 203 GLU HN . 52655 1 859 . 1 . 1 203 203 GLU C C 13 177.40 0.02 . . . . . . . 203 GLU C . 52655 1 860 . 1 . 1 203 203 GLU CA C 13 57.45 0.02 . . . . . . . 203 GLU CA . 52655 1 861 . 1 . 1 203 203 GLU CB C 13 29.70 0.02 . . . . . . . 203 GLU CB . 52655 1 862 . 1 . 1 203 203 GLU N N 15 123.22 0.04 . . . . . . . 203 GLU N . 52655 1 863 . 1 . 1 204 204 ARG H H 1 8.23 0.01 . . . . . . . 204 ARG HN . 52655 1 864 . 1 . 1 204 204 ARG C C 13 177.57 0.02 . . . . . . . 204 ARG C . 52655 1 865 . 1 . 1 204 204 ARG CA C 13 57.08 0.02 . . . . . . . 204 ARG CA . 52655 1 866 . 1 . 1 204 204 ARG CB C 13 30.36 0.02 . . . . . . . 204 ARG CB . 52655 1 867 . 1 . 1 204 204 ARG N N 15 121.08 0.04 . . . . . . . 204 ARG N . 52655 1 868 . 1 . 1 205 205 GLU H H 1 8.44 0.01 . . . . . . . 205 GLU HN . 52655 1 869 . 1 . 1 205 205 GLU C C 13 177.33 0.02 . . . . . . . 205 GLU C . 52655 1 870 . 1 . 1 205 205 GLU CA C 13 57.67 0.02 . . . . . . . 205 GLU CA . 52655 1 871 . 1 . 1 205 205 GLU CB C 13 29.48 0.02 . . . . . . . 205 GLU CB . 52655 1 872 . 1 . 1 205 205 GLU N N 15 120.66 0.04 . . . . . . . 205 GLU N . 52655 1 873 . 1 . 1 206 206 ALA H H 1 8.17 0.01 . . . . . . . 206 ALA HN . 52655 1 874 . 1 . 1 206 206 ALA C C 13 178.84 0.02 . . . . . . . 206 ALA C . 52655 1 875 . 1 . 1 206 206 ALA CA C 13 53.44 0.02 . . . . . . . 206 ALA CA . 52655 1 876 . 1 . 1 206 206 ALA CB C 13 18.49 0.02 . . . . . . . 206 ALA CB . 52655 1 877 . 1 . 1 206 206 ALA N N 15 123.56 0.04 . . . . . . . 206 ALA N . 52655 1 878 . 1 . 1 207 207 GLN H H 1 8.16 0.01 . . . . . . . 207 GLN HN . 52655 1 879 . 1 . 1 207 207 GLN C C 13 176.99 0.02 . . . . . . . 207 GLN C . 52655 1 880 . 1 . 1 207 207 GLN CA C 13 56.82 0.02 . . . . . . . 207 GLN CA . 52655 1 881 . 1 . 1 207 207 GLN CB C 13 28.80 0.02 . . . . . . . 207 GLN CB . 52655 1 882 . 1 . 1 207 207 GLN N N 15 118.08 0.04 . . . . . . . 207 GLN N . 52655 1 883 . 1 . 1 208 208 GLN H H 1 8.21 0.01 . . . . . . . 208 GLN HN . 52655 1 884 . 1 . 1 208 208 GLN C C 13 176.40 0.02 . . . . . . . 208 GLN C . 52655 1 885 . 1 . 1 208 208 GLN CA C 13 56.57 0.02 . . . . . . . 208 GLN CA . 52655 1 886 . 1 . 1 208 208 GLN CB C 13 28.93 0.02 . . . . . . . 208 GLN CB . 52655 1 887 . 1 . 1 208 208 GLN N N 15 119.98 0.04 . . . . . . . 208 GLN N . 52655 1 888 . 1 . 1 209 209 GLN H H 1 8.24 0.01 . . . . . . . 209 GLN HN . 52655 1 889 . 1 . 1 209 209 GLN C C 13 176.40 0.02 . . . . . . . 209 GLN C . 52655 1 890 . 1 . 1 209 209 GLN CA C 13 56.44 0.02 . . . . . . . 209 GLN CA . 52655 1 891 . 1 . 1 209 209 GLN CB C 13 29.03 0.02 . . . . . . . 209 GLN CB . 52655 1 892 . 1 . 1 209 209 GLN N N 15 119.91 0.04 . . . . . . . 209 GLN N . 52655 1 893 . 1 . 1 210 210 GLN H H 1 8.22 0.01 . . . . . . . 210 GLN HN . 52655 1 894 . 1 . 1 210 210 GLN C C 13 176.11 0.02 . . . . . . . 210 GLN C . 52655 1 895 . 1 . 1 210 210 GLN CA C 13 56.41 0.02 . . . . . . . 210 GLN CA . 52655 1 896 . 1 . 1 210 210 GLN CB C 13 28.95 0.02 . . . . . . . 210 GLN CB . 52655 1 897 . 1 . 1 210 210 GLN N N 15 119.75 0.04 . . . . . . . 210 GLN N . 52655 1 898 . 1 . 1 211 211 HIS H H 1 8.32 0.01 . . . . . . . 211 HIS HN . 52655 1 899 . 1 . 1 211 211 HIS C C 13 174.61 0.02 . . . . . . . 211 HIS C . 52655 1 900 . 1 . 1 211 211 HIS CA C 13 55.76 0.02 . . . . . . . 211 HIS CA . 52655 1 901 . 1 . 1 211 211 HIS CB C 13 29.12 0.02 . . . . . . . 211 HIS CB . 52655 1 902 . 1 . 1 211 211 HIS N N 15 118.49 0.04 . . . . . . . 211 HIS N . 52655 1 903 . 1 . 1 212 212 LEU H H 1 8.05 0.01 . . . . . . . 212 LEU HN . 52655 1 904 . 1 . 1 212 212 LEU C C 13 176.85 0.02 . . . . . . . 212 LEU C . 52655 1 905 . 1 . 1 212 212 LEU CA C 13 55.43 0.02 . . . . . . . 212 LEU CA . 52655 1 906 . 1 . 1 212 212 LEU CB C 13 42.18 0.02 . . . . . . . 212 LEU CB . 52655 1 907 . 1 . 1 212 212 LEU N N 15 122.12 0.04 . . . . . . . 212 LEU N . 52655 1 908 . 1 . 1 213 213 TYR H H 1 8.09 0.01 . . . . . . . 213 TYR HN . 52655 1 909 . 1 . 1 213 213 TYR C C 13 175.49 0.02 . . . . . . . 213 TYR C . 52655 1 910 . 1 . 1 213 213 TYR CA C 13 57.71 0.02 . . . . . . . 213 TYR CA . 52655 1 911 . 1 . 1 213 213 TYR CB C 13 38.45 0.02 . . . . . . . 213 TYR CB . 52655 1 912 . 1 . 1 213 213 TYR N N 15 120.37 0.04 . . . . . . . 213 TYR N . 52655 1 913 . 1 . 1 214 214 ARG H H 1 8.11 0.01 . . . . . . . 214 ARG HN . 52655 1 914 . 1 . 1 214 214 ARG C C 13 175.75 0.02 . . . . . . . 214 ARG C . 52655 1 915 . 1 . 1 214 214 ARG CA C 13 55.81 0.02 . . . . . . . 214 ARG CA . 52655 1 916 . 1 . 1 214 214 ARG CB C 13 30.82 0.02 . . . . . . . 214 ARG CB . 52655 1 917 . 1 . 1 214 214 ARG N N 15 122.53 0.04 . . . . . . . 214 ARG N . 52655 1 918 . 1 . 1 215 215 VAL H H 1 8.06 0.01 . . . . . . . 215 VAL HN . 52655 1 919 . 1 . 1 215 215 VAL C C 13 175.63 0.02 . . . . . . . 215 VAL C . 52655 1 920 . 1 . 1 215 215 VAL CA C 13 62.1 0.02 . . . . . . . 215 VAL CA . 52655 1 921 . 1 . 1 215 215 VAL CB C 13 32.7 0.02 . . . . . . . 215 VAL CB . 52655 1 922 . 1 . 1 215 215 VAL N N 15 120.64 0.04 . . . . . . . 215 VAL N . 52655 1 923 . 1 . 1 216 216 ASN H H 1 8.47 0.01 . . . . . . . 216 ASN HN . 52655 1 924 . 1 . 1 216 216 ASN C C 13 175.18 0.02 . . . . . . . 216 ASN C . 52655 1 925 . 1 . 1 216 216 ASN CA C 13 52.94 0.02 . . . . . . . 216 ASN CA . 52655 1 926 . 1 . 1 216 216 ASN CB C 13 38.76 0.02 . . . . . . . 216 ASN CB . 52655 1 927 . 1 . 1 216 216 ASN N N 15 122.32 0.04 . . . . . . . 216 ASN N . 52655 1 928 . 1 . 1 217 217 ILE H H 1 8.11 0.01 . . . . . . . 217 ILE HN . 52655 1 929 . 1 . 1 217 217 ILE C C 13 175.9 0.02 . . . . . . . 217 ILE C . 52655 1 930 . 1 . 1 217 217 ILE CA C 13 61.33 0.02 . . . . . . . 217 ILE CA . 52655 1 931 . 1 . 1 217 217 ILE CB C 13 38.51 0.02 . . . . . . . 217 ILE CB . 52655 1 932 . 1 . 1 217 217 ILE N N 15 121.22 0.04 . . . . . . . 217 ILE N . 52655 1 933 . 1 . 1 218 218 ASN H H 1 8.45 0.01 . . . . . . . 218 ASN HN . 52655 1 934 . 1 . 1 218 218 ASN C C 13 174.93 0.02 . . . . . . . 218 ASN C . 52655 1 935 . 1 . 1 218 218 ASN CA C 13 53.28 0.02 . . . . . . . 218 ASN CA . 52655 1 936 . 1 . 1 218 218 ASN CB C 13 38.63 0.02 . . . . . . . 218 ASN CB . 52655 1 937 . 1 . 1 218 218 ASN N N 15 121.66 0.04 . . . . . . . 218 ASN N . 52655 1 938 . 1 . 1 219 219 ASN H H 1 8.35 0.01 . . . . . . . 219 ASN HN . 52655 1 939 . 1 . 1 219 219 ASN C C 13 175.04 0.02 . . . . . . . 219 ASN C . 52655 1 940 . 1 . 1 219 219 ASN CA C 13 53.36 0.02 . . . . . . . 219 ASN CA . 52655 1 941 . 1 . 1 219 219 ASN CB C 13 38.62 0.02 . . . . . . . 219 ASN CB . 52655 1 942 . 1 . 1 219 219 ASN N N 15 119.52 0.04 . . . . . . . 219 ASN N . 52655 1 943 . 1 . 1 220 220 SER H H 1 8.21 0.01 . . . . . . . 220 SER HN . 52655 1 944 . 1 . 1 220 220 SER C C 13 174.01 0.02 . . . . . . . 220 SER C . 52655 1 945 . 1 . 1 220 220 SER CA C 13 58.38 0.02 . . . . . . . 220 SER CA . 52655 1 946 . 1 . 1 220 220 SER CB C 13 63.63 0.02 . . . . . . . 220 SER CB . 52655 1 947 . 1 . 1 220 220 SER N N 15 115.66 0.04 . . . . . . . 220 SER N . 52655 1 948 . 1 . 1 221 221 MET H H 1 8.24 0.01 . . . . . . . 221 MET HN . 52655 1 949 . 1 . 1 221 221 MET C C 13 173.56 0.02 . . . . . . . 221 MET C . 52655 1 950 . 1 . 1 221 221 MET CA C 13 57.54 0.02 . . . . . . . 221 MET CA . 52655 1 951 . 1 . 1 221 221 MET CB C 13 32.29 0.02 . . . . . . . 221 MET CB . 52655 1 952 . 1 . 1 221 221 MET N N 15 122.93 0.04 . . . . . . . 221 MET N . 52655 1 953 . 1 . 1 222 222 PRO C C 13 174.69 0.02 . . . . . . . 222 PRO C . 52655 1 954 . 1 . 1 222 222 PRO N N 15 138.71 0.04 . . . . . . . 222 PRO N . 52655 1 955 . 1 . 1 223 223 PRO C C 13 177.56 0.02 . . . . . . . 223 PRO C . 52655 1 956 . 1 . 1 223 223 PRO CA C 13 63.17 0.02 . . . . . . . 223 PRO CA . 52655 1 957 . 1 . 1 223 223 PRO CB C 13 31.97 0.02 . . . . . . . 223 PRO CB . 52655 1 958 . 1 . 1 223 223 PRO N N 15 135.25 0.04 . . . . . . . 223 PRO N . 52655 1 959 . 1 . 1 224 224 GLY H H 1 8.43 0.01 . . . . . . . 224 GLY HN . 52655 1 960 . 1 . 1 224 224 GLY C C 13 174.16 0.02 . . . . . . . 224 GLY C . 52655 1 961 . 1 . 1 224 224 GLY CA C 13 45.15 0.02 . . . . . . . 224 GLY CA . 52655 1 962 . 1 . 1 224 224 GLY N N 15 108.76 0.04 . . . . . . . 224 GLY N . 52655 1 963 . 1 . 1 225 225 ARG H H 1 8.20 0.01 . . . . . . . 225 ARG HN . 52655 1 964 . 1 . 1 225 225 ARG C C 13 176.51 0.02 . . . . . . . 225 ARG C . 52655 1 965 . 1 . 1 225 225 ARG CA C 13 55.88 0.02 . . . . . . . 225 ARG CA . 52655 1 966 . 1 . 1 225 225 ARG CB C 13 30.74 0.02 . . . . . . . 225 ARG CB . 52655 1 967 . 1 . 1 225 225 ARG N N 15 120.41 0.04 . . . . . . . 225 ARG N . 52655 1 968 . 1 . 1 226 226 THR H H 1 8.21 0.01 . . . . . . . 226 THR HN . 52655 1 969 . 1 . 1 226 226 THR C C 13 175.02 0.02 . . . . . . . 226 THR C . 52655 1 970 . 1 . 1 226 226 THR CA C 13 61.85 0.02 . . . . . . . 226 THR CA . 52655 1 971 . 1 . 1 226 226 THR CB C 13 69.82 0.02 . . . . . . . 226 THR CB . 52655 1 972 . 1 . 1 226 226 THR N N 15 114.67 0.04 . . . . . . . 226 THR N . 52655 1 973 . 1 . 1 227 227 GLY H H 1 8.45 0.01 . . . . . . . 227 GLY HN . 52655 1 974 . 1 . 1 227 227 GLY C C 13 174.13 0.02 . . . . . . . 227 GLY C . 52655 1 975 . 1 . 1 227 227 GLY CA C 13 45.23 0.02 . . . . . . . 227 GLY CA . 52655 1 976 . 1 . 1 227 227 GLY N N 15 110.95 0.04 . . . . . . . 227 GLY N . 52655 1 977 . 1 . 1 228 228 MET H H 1 8.26 0.01 . . . . . . . 228 MET HN . 52655 1 978 . 1 . 1 228 228 MET C C 13 176.68 0.02 . . . . . . . 228 MET C . 52655 1 979 . 1 . 1 228 228 MET CA C 13 55.33 0.02 . . . . . . . 228 MET CA . 52655 1 980 . 1 . 1 228 228 MET CB C 13 32.80 0.02 . . . . . . . 228 MET CB . 52655 1 981 . 1 . 1 228 228 MET N N 15 119.62 0.04 . . . . . . . 228 MET N . 52655 1 982 . 1 . 1 229 229 GLY H H 1 8.47 0.01 . . . . . . . 229 GLY HN . 52655 1 983 . 1 . 1 229 229 GLY C C 13 173.79 0.02 . . . . . . . 229 GLY C . 52655 1 984 . 1 . 1 229 229 GLY CA C 13 44.91 0.02 . . . . . . . 229 GLY CA . 52655 1 985 . 1 . 1 229 229 GLY N N 15 109.89 0.04 . . . . . . . 229 GLY N . 52655 1 986 . 1 . 1 230 230 THR H H 1 8.09 0.01 . . . . . . . 230 THR HN . 52655 1 987 . 1 . 1 230 230 THR C C 13 173.10 0.02 . . . . . . . 230 THR C . 52655 1 988 . 1 . 1 230 230 THR CA C 13 59.57 0.02 . . . . . . . 230 THR CA . 52655 1 989 . 1 . 1 230 230 THR CB C 13 69.47 0.02 . . . . . . . 230 THR CB . 52655 1 990 . 1 . 1 230 230 THR N N 15 115.82 0.04 . . . . . . . 230 THR N . 52655 1 991 . 1 . 1 231 231 PRO C C 13 177.56 0.02 . . . . . . . 231 PRO C . 52655 1 992 . 1 . 1 231 231 PRO CA C 13 63.56 0.02 . . . . . . . 231 PRO CA . 52655 1 993 . 1 . 1 231 231 PRO CB C 13 31.72 0.02 . . . . . . . 231 PRO CB . 52655 1 994 . 1 . 1 231 231 PRO N N 15 139.35 0.04 . . . . . . . 231 PRO N . 52655 1 995 . 1 . 1 232 232 GLY H H 1 8.53 0.01 . . . . . . . 232 GLY HN . 52655 1 996 . 1 . 1 232 232 GLY C C 13 174.35 0.02 . . . . . . . 232 GLY C . 52655 1 997 . 1 . 1 232 232 GLY CA C 13 45.23 0.02 . . . . . . . 232 GLY CA . 52655 1 998 . 1 . 1 232 232 GLY N N 15 109.70 0.04 . . . . . . . 232 GLY N . 52655 1 999 . 1 . 1 233 233 SER H H 1 8.13 0.01 . . . . . . . 233 SER HN . 52655 1 1000 . 1 . 1 233 233 SER C C 13 174.56 0.02 . . . . . . . 233 SER C . 52655 1 1001 . 1 . 1 233 233 SER CA C 13 58.36 0.02 . . . . . . . 233 SER CA . 52655 1 1002 . 1 . 1 233 233 SER CB C 13 63.72 0.02 . . . . . . . 233 SER CB . 52655 1 1003 . 1 . 1 233 233 SER N N 15 115.37 0.04 . . . . . . . 233 SER N . 52655 1 1004 . 1 . 1 234 234 GLN H H 1 8.44 0.01 . . . . . . . 234 GLN HN . 52655 1 1005 . 1 . 1 234 234 GLN C C 13 175.70 0.02 . . . . . . . 234 GLN C . 52655 1 1006 . 1 . 1 234 234 GLN CA C 13 55.76 0.02 . . . . . . . 234 GLN CA . 52655 1 1007 . 1 . 1 234 234 GLN CB C 13 29.26 0.02 . . . . . . . 234 GLN CB . 52655 1 1008 . 1 . 1 234 234 GLN N N 15 121.68 0.04 . . . . . . . 234 GLN N . 52655 1 1009 . 1 . 1 235 235 MET H H 1 8.29 0.01 . . . . . . . 235 MET HN . 52655 1 1010 . 1 . 1 235 235 MET C C 13 175.42 0.02 . . . . . . . 235 MET C . 52655 1 1011 . 1 . 1 235 235 MET CA C 13 55.08 0.02 . . . . . . . 235 MET CA . 52655 1 1012 . 1 . 1 235 235 MET CB C 13 32.89 0.02 . . . . . . . 235 MET CB . 52655 1 1013 . 1 . 1 235 235 MET N N 15 121.38 0.04 . . . . . . . 235 MET N . 52655 1 1014 . 1 . 1 236 236 ALA H H 1 8.28 0.01 . . . . . . . 236 ALA HN . 52655 1 1015 . 1 . 1 236 236 ALA C C 13 175.27 0.02 . . . . . . . 236 ALA C . 52655 1 1016 . 1 . 1 236 236 ALA CA C 13 55.01 0.02 . . . . . . . 236 ALA CA . 52655 1 1017 . 1 . 1 236 236 ALA CB C 13 18.01 0.02 . . . . . . . 236 ALA CB . 52655 1 1018 . 1 . 1 236 236 ALA N N 15 126.71 0.04 . . . . . . . 236 ALA N . 52655 1 1019 . 1 . 1 237 237 PRO C C 13 176.90 0.02 . . . . . . . 237 PRO C . 52655 1 1020 . 1 . 1 237 237 PRO CA C 13 62.83 0.02 . . . . . . . 237 PRO CA . 52655 1 1021 . 1 . 1 237 237 PRO CB C 13 31.88 0.02 . . . . . . . 237 PRO CB . 52655 1 1022 . 1 . 1 237 237 PRO N N 15 135.47 0.04 . . . . . . . 237 PRO N . 52655 1 1023 . 1 . 1 238 238 VAL H H 1 8.20 0.01 . . . . . . . 238 VAL HN . 52655 1 1024 . 1 . 1 238 238 VAL C C 13 176.17 0.02 . . . . . . . 238 VAL C . 52655 1 1025 . 1 . 1 238 238 VAL CA C 13 62.09 0.02 . . . . . . . 238 VAL CA . 52655 1 1026 . 1 . 1 238 238 VAL CB C 13 32.67 0.02 . . . . . . . 238 VAL CB . 52655 1 1027 . 1 . 1 238 238 VAL N N 15 120.18 0.04 . . . . . . . 238 VAL N . 52655 1 1028 . 1 . 1 239 239 SER H H 1 8.33 0.01 . . . . . . . 239 SER HN . 52655 1 1029 . 1 . 1 239 239 SER C C 13 174.24 0.02 . . . . . . . 239 SER C . 52655 1 1030 . 1 . 1 239 239 SER CA C 13 57.80 0.02 . . . . . . . 239 SER CA . 52655 1 1031 . 1 . 1 239 239 SER CB C 13 63.66 0.02 . . . . . . . 239 SER CB . 52655 1 1032 . 1 . 1 239 239 SER N N 15 119.19 0.04 . . . . . . . 239 SER N . 52655 1 1033 . 1 . 1 240 240 LEU H H 1 8.31 0.01 . . . . . . . 240 LEU HN . 52655 1 1034 . 1 . 1 240 240 LEU C C 13 176.84 0.02 . . . . . . . 240 LEU C . 52655 1 1035 . 1 . 1 240 240 LEU CA C 13 54.92 0.02 . . . . . . . 240 LEU CA . 52655 1 1036 . 1 . 1 240 240 LEU CB C 13 42.33 0.02 . . . . . . . 240 LEU CB . 52655 1 1037 . 1 . 1 240 240 LEU N N 15 124.39 0.04 . . . . . . . 240 LEU N . 52655 1 1038 . 1 . 1 241 241 ASN H H 1 8.42 0.01 . . . . . . . 241 ASN HN . 52655 1 1039 . 1 . 1 241 241 ASN C C 13 174.49 0.02 . . . . . . . 241 ASN C . 52655 1 1040 . 1 . 1 241 241 ASN CA C 13 53.08 0.02 . . . . . . . 241 ASN CA . 52655 1 1041 . 1 . 1 241 241 ASN CB C 13 38.58 0.02 . . . . . . . 241 ASN CB . 52655 1 1042 . 1 . 1 241 241 ASN N N 15 119.55 0.04 . . . . . . . 241 ASN N . 52655 1 1043 . 1 . 1 242 242 VAL H H 1 7.93 0.01 . . . . . . . 242 VAL HN . 52655 1 1044 . 1 . 1 242 242 VAL C C 13 174.11 0.02 . . . . . . . 242 VAL C . 52655 1 1045 . 1 . 1 242 242 VAL CA C 13 59.59 0.02 . . . . . . . 242 VAL CA . 52655 1 1046 . 1 . 1 242 242 VAL CB C 13 32.47 0.02 . . . . . . . 242 VAL CB . 52655 1 1047 . 1 . 1 242 242 VAL N N 15 121.52 0.04 . . . . . . . 242 VAL N . 52655 1 1048 . 1 . 1 243 243 PRO C C 13 176.46 0.02 . . . . . . . 243 PRO C . 52655 1 1049 . 1 . 1 243 243 PRO CA C 13 62.91 0.02 . . . . . . . 243 PRO CA . 52655 1 1050 . 1 . 1 243 243 PRO CB C 13 31.94 0.02 . . . . . . . 243 PRO CB . 52655 1 1051 . 1 . 1 243 243 PRO N N 15 139.10 0.04 . . . . . . . 243 PRO N . 52655 1 1052 . 1 . 1 244 244 ARG H H 1 8.38 0.01 . . . . . . . 244 ARG HN . 52655 1 1053 . 1 . 1 244 244 ARG C C 13 174.45 0.02 . . . . . . . 244 ARG C . 52655 1 1054 . 1 . 1 244 244 ARG CA C 13 53.71 0.02 . . . . . . . 244 ARG CA . 52655 1 1055 . 1 . 1 244 244 ARG CB C 13 30.15 0.02 . . . . . . . 244 ARG CB . 52655 1 1056 . 1 . 1 244 244 ARG N N 15 122.23 0.04 . . . . . . . 244 ARG N . 52655 1 1057 . 1 . 1 245 245 PRO C C 13 176.64 0.02 . . . . . . . 245 PRO C . 52655 1 1058 . 1 . 1 245 245 PRO CA C 13 63.15 0.02 . . . . . . . 245 PRO CA . 52655 1 1059 . 1 . 1 245 245 PRO CB C 13 31.96 0.02 . . . . . . . 245 PRO CB . 52655 1 1060 . 1 . 1 245 245 PRO N N 15 136.56 0.04 . . . . . . . 245 PRO N . 52655 1 1061 . 1 . 1 246 246 ASN H H 1 8.51 0.01 . . . . . . . 246 ASN HN . 52655 1 1062 . 1 . 1 246 246 ASN C C 13 174.99 0.02 . . . . . . . 246 ASN C . 52655 1 1063 . 1 . 1 246 246 ASN CA C 13 53.30 0.02 . . . . . . . 246 ASN CA . 52655 1 1064 . 1 . 1 246 246 ASN CB C 13 38.39 0.02 . . . . . . . 246 ASN CB . 52655 1 1065 . 1 . 1 246 246 ASN N N 15 118.14 0.04 . . . . . . . 246 ASN N . 52655 1 1066 . 1 . 1 247 247 GLN H H 1 8.26 0.01 . . . . . . . 247 GLN HN . 52655 1 1067 . 1 . 1 247 247 GLN C C 13 175.71 0.02 . . . . . . . 247 GLN C . 52655 1 1068 . 1 . 1 247 247 GLN CA C 13 55.69 0.02 . . . . . . . 247 GLN CA . 52655 1 1069 . 1 . 1 247 247 GLN CB C 13 29.45 0.02 . . . . . . . 247 GLN CB . 52655 1 1070 . 1 . 1 247 247 GLN N N 15 120.50 0.04 . . . . . . . 247 GLN N . 52655 1 1071 . 1 . 1 248 248 VAL H H 1 8.22 0.01 . . . . . . . 248 VAL HN . 52655 1 1072 . 1 . 1 248 248 VAL C C 13 176.01 0.02 . . . . . . . 248 VAL C . 52655 1 1073 . 1 . 1 248 248 VAL CA C 13 62.08 0.02 . . . . . . . 248 VAL CA . 52655 1 1074 . 1 . 1 248 248 VAL CB C 13 32.60 0.02 . . . . . . . 248 VAL CB . 52655 1 1075 . 1 . 1 248 248 VAL N N 15 121.35 0.04 . . . . . . . 248 VAL N . 52655 1 1076 . 1 . 1 249 249 SER H H 1 8.39 0.01 . . . . . . . 249 SER HN . 52655 1 1077 . 1 . 1 249 249 SER C C 13 174.33 0.02 . . . . . . . 249 SER C . 52655 1 1078 . 1 . 1 249 249 SER CA C 13 58.02 0.02 . . . . . . . 249 SER CA . 52655 1 1079 . 1 . 1 249 249 SER CB C 13 63.93 0.02 . . . . . . . 249 SER CB . 52655 1 1080 . 1 . 1 249 249 SER N N 15 119.50 0.04 . . . . . . . 249 SER N . 52655 1 1081 . 1 . 1 250 250 GLY H H 1 8.20 0.01 . . . . . . . 250 GLY HN . 52655 1 1082 . 1 . 1 250 250 GLY C C 13 171.35 0.02 . . . . . . . 250 GLY C . 52655 1 1083 . 1 . 1 250 250 GLY CA C 13 44.50 0.02 . . . . . . . 250 GLY CA . 52655 1 1084 . 1 . 1 250 250 GLY N N 15 110.88 0.04 . . . . . . . 250 GLY N . 52655 1 1085 . 1 . 1 251 251 PRO C C 13 176.79 0.02 . . . . . . . 251 PRO C . 52655 1 1086 . 1 . 1 251 251 PRO CA C 13 62.81 0.02 . . . . . . . 251 PRO CA . 52655 1 1087 . 1 . 1 251 251 PRO CB C 13 32.04 0.02 . . . . . . . 251 PRO CB . 52655 1 1088 . 1 . 1 251 251 PRO N N 15 134.26 0.04 . . . . . . . 251 PRO N . 52655 1 1089 . 1 . 1 252 252 VAL H H 1 8.25 0.01 . . . . . . . 252 VAL HN . 52655 1 1090 . 1 . 1 252 252 VAL C C 13 176.07 0.02 . . . . . . . 252 VAL C . 52655 1 1091 . 1 . 1 252 252 VAL CA C 13 62.20 0.02 . . . . . . . 252 VAL CA . 52655 1 1092 . 1 . 1 252 252 VAL CB C 13 32.51 0.02 . . . . . . . 252 VAL CB . 52655 1 1093 . 1 . 1 252 252 VAL N N 15 120.80 0.04 . . . . . . . 252 VAL N . 52655 1 1094 . 1 . 1 253 253 MET H H 1 8.45 0.01 . . . . . . . 253 MET HN . 52655 1 1095 . 1 . 1 253 253 MET C C 13 174.09 0.02 . . . . . . . 253 MET C . 52655 1 1096 . 1 . 1 253 253 MET CA C 13 52.72 0.02 . . . . . . . 253 MET CA . 52655 1 1097 . 1 . 1 253 253 MET CB C 13 32.29 0.02 . . . . . . . 253 MET CB . 52655 1 1098 . 1 . 1 253 253 MET N N 15 126.01 0.04 . . . . . . . 253 MET N . 52655 1 1099 . 1 . 1 254 254 PRO C C 13 176.61 0.02 . . . . . . . 254 PRO C . 52655 1 1100 . 1 . 1 254 254 PRO CA C 13 62.91 0.02 . . . . . . . 254 PRO CA . 52655 1 1101 . 1 . 1 254 254 PRO CB C 13 32.00 0.02 . . . . . . . 254 PRO CB . 52655 1 1102 . 1 . 1 254 254 PRO N N 15 136.64 0.04 . . . . . . . 254 PRO N . 52655 1 1103 . 1 . 1 255 255 SER H H 1 8.34 0.01 . . . . . . . 255 SER HN . 52655 1 1104 . 1 . 1 255 255 SER C C 13 174.08 0.02 . . . . . . . 255 SER C . 52655 1 1105 . 1 . 1 255 255 SER CA C 13 58.11 0.02 . . . . . . . 255 SER CA . 52655 1 1106 . 1 . 1 255 255 SER CB C 13 63.55 0.02 . . . . . . . 255 SER CB . 52655 1 1107 . 1 . 1 255 255 SER N N 15 115.84 0.04 . . . . . . . 255 SER N . 52655 1 1108 . 1 . 1 256 256 MET H H 1 8.27 0.01 . . . . . . . 256 MET HN . 52655 1 1109 . 1 . 1 256 256 MET C C 13 173.56 0.02 . . . . . . . 256 MET C . 52655 1 1110 . 1 . 1 256 256 MET CA C 13 52.91 0.02 . . . . . . . 256 MET CA . 52655 1 1111 . 1 . 1 256 256 MET CB C 13 32.63 0.02 . . . . . . . 256 MET CB . 52655 1 1112 . 1 . 1 256 256 MET N N 15 123.12 0.04 . . . . . . . 256 MET N . 52655 1 1113 . 1 . 1 257 257 PRO C C 13 174.71 0.02 . . . . . . . 257 PRO C . 52655 1 1114 . 1 . 1 257 257 PRO N N 15 138.74 0.04 . . . . . . . 257 PRO N . 52655 1 1115 . 1 . 1 258 258 PRO C C 13 177.56 0.02 . . . . . . . 258 PRO C . 52655 1 1116 . 1 . 1 258 258 PRO CA C 13 63.15 0.02 . . . . . . . 258 PRO CA . 52655 1 1117 . 1 . 1 258 258 PRO CB C 13 31.79 0.02 . . . . . . . 258 PRO CB . 52655 1 1118 . 1 . 1 258 258 PRO N N 15 135.16 0.04 . . . . . . . 258 PRO N . 52655 1 1119 . 1 . 1 259 259 GLY H H 1 8.36 0.01 . . . . . . . 259 GLY HN . 52655 1 1120 . 1 . 1 259 259 GLY C C 13 174.09 0.02 . . . . . . . 259 GLY C . 52655 1 1121 . 1 . 1 259 259 GLY CA C 13 45.13 0.02 . . . . . . . 259 GLY CA . 52655 1 1122 . 1 . 1 259 259 GLY N N 15 108.72 0.04 . . . . . . . 259 GLY N . 52655 1 1123 . 1 . 1 260 260 GLN H H 1 8.08 0.01 . . . . . . . 260 GLN HN . 52655 1 1124 . 1 . 1 260 260 GLN C C 13 175.61 0.02 . . . . . . . 260 GLN C . 52655 1 1125 . 1 . 1 260 260 GLN CA C 13 55.79 0.02 . . . . . . . 260 GLN CA . 52655 1 1126 . 1 . 1 260 260 GLN CB C 13 29.19 0.02 . . . . . . . 260 GLN CB . 52655 1 1127 . 1 . 1 260 260 GLN N N 15 119.61 0.04 . . . . . . . 260 GLN N . 52655 1 1128 . 1 . 1 261 261 TRP H H 1 8.10 0.01 . . . . . . . 261 TRP HN . 52655 1 1129 . 1 . 1 261 261 TRP C C 13 175.93 0.02 . . . . . . . 261 TRP C . 52655 1 1130 . 1 . 1 261 261 TRP CA C 13 57.09 0.02 . . . . . . . 261 TRP CA . 52655 1 1131 . 1 . 1 261 261 TRP CB C 13 29.25 0.02 . . . . . . . 261 TRP CB . 52655 1 1132 . 1 . 1 261 261 TRP N N 15 121.55 0.04 . . . . . . . 261 TRP N . 52655 1 1133 . 1 . 1 262 262 GLN H H 1 8.05 0.01 . . . . . . . 262 GLN HN . 52655 1 1134 . 1 . 1 262 262 GLN C C 13 175.14 0.02 . . . . . . . 262 GLN C . 52655 1 1135 . 1 . 1 262 262 GLN CA C 13 55.61 0.02 . . . . . . . 262 GLN CA . 52655 1 1136 . 1 . 1 262 262 GLN CB C 13 29.46 0.02 . . . . . . . 262 GLN CB . 52655 1 1137 . 1 . 1 262 262 GLN N N 15 121.85 0.04 . . . . . . . 262 GLN N . 52655 1 1138 . 1 . 1 263 263 GLN H H 1 8.15 0.01 . . . . . . . 263 GLN HN . 52655 1 1139 . 1 . 1 263 263 GLN C C 13 175.08 0.02 . . . . . . . 263 GLN C . 52655 1 1140 . 1 . 1 263 263 GLN CA C 13 55.38 0.02 . . . . . . . 263 GLN CA . 52655 1 1141 . 1 . 1 263 263 GLN CB C 13 29.43 0.02 . . . . . . . 263 GLN CB . 52655 1 1142 . 1 . 1 263 263 GLN N N 15 121.28 0.04 . . . . . . . 263 GLN N . 52655 1 1143 . 1 . 1 264 264 ALA H H 1 8.27 0.01 . . . . . . . 264 ALA HN . 52655 1 1144 . 1 . 1 264 264 ALA C C 13 175.22 0.02 . . . . . . . 264 ALA C . 52655 1 1145 . 1 . 1 264 264 ALA CA C 13 50.24 0.02 . . . . . . . 264 ALA CA . 52655 1 1146 . 1 . 1 264 264 ALA CB C 13 18.07 0.02 . . . . . . . 264 ALA CB . 52655 1 1147 . 1 . 1 264 264 ALA N N 15 127.08 0.04 . . . . . . . 264 ALA N . 52655 1 1148 . 1 . 1 265 265 PRO C C 13 176.57 0.02 . . . . . . . 265 PRO C . 52655 1 1149 . 1 . 1 265 265 PRO CA C 13 62.62 0.02 . . . . . . . 265 PRO CA . 52655 1 1150 . 1 . 1 265 265 PRO CB C 13 31.79 0.02 . . . . . . . 265 PRO CB . 52655 1 1151 . 1 . 1 265 265 PRO N N 15 135.04 0.04 . . . . . . . 265 PRO N . 52655 1 1152 . 1 . 1 266 266 LEU H H 1 8.28 0.01 . . . . . . . 266 LEU HN . 52655 1 1153 . 1 . 1 266 266 LEU C C 13 175.49 0.02 . . . . . . . 266 LEU C . 52655 1 1154 . 1 . 1 266 266 LEU CA C 13 52.93 0.02 . . . . . . . 266 LEU CA . 52655 1 1155 . 1 . 1 266 266 LEU CB C 13 41.41 0.02 . . . . . . . 266 LEU CB . 52655 1 1156 . 1 . 1 266 266 LEU N N 15 123.58 0.04 . . . . . . . 266 LEU N . 52655 1 1157 . 1 . 1 267 267 PRO C C 13 176.84 0.02 . . . . . . . 267 PRO C . 52655 1 1158 . 1 . 1 267 267 PRO CA C 13 63.00 0.02 . . . . . . . 267 PRO CA . 52655 1 1159 . 1 . 1 267 267 PRO CB C 13 31.79 0.02 . . . . . . . 267 PRO CB . 52655 1 1160 . 1 . 1 267 267 PRO N N 15 136.09 0.04 . . . . . . . 267 PRO N . 52655 1 1161 . 1 . 1 268 268 GLN H H 1 8.44 0.01 . . . . . . . 268 GLN HN . 52655 1 1162 . 1 . 1 268 268 GLN C C 13 175.93 0.02 . . . . . . . 268 GLN C . 52655 1 1163 . 1 . 1 268 268 GLN CA C 13 55.93 0.02 . . . . . . . 268 GLN CA . 52655 1 1164 . 1 . 1 268 268 GLN CB C 13 29.25 0.02 . . . . . . . 268 GLN CB . 52655 1 1165 . 1 . 1 268 268 GLN N N 15 120.02 0.04 . . . . . . . 268 GLN N . 52655 1 1166 . 1 . 1 269 269 GLN H H 1 8.39 0.01 . . . . . . . 269 GLN HN . 52655 1 1167 . 1 . 1 269 269 GLN C C 13 175.57 0.02 . . . . . . . 269 GLN C . 52655 1 1168 . 1 . 1 269 269 GLN CA C 13 55.48 0.02 . . . . . . . 269 GLN CA . 52655 1 1169 . 1 . 1 269 269 GLN CB C 13 29.38 0.02 . . . . . . . 269 GLN CB . 52655 1 1170 . 1 . 1 269 269 GLN N N 15 121.61 0.04 . . . . . . . 269 GLN N . 52655 1 1171 . 1 . 1 270 270 GLN H H 1 8.43 0.01 . . . . . . . 270 GLN HN . 52655 1 1172 . 1 . 1 270 270 GLN C C 13 173.75 0.02 . . . . . . . 270 GLN C . 52655 1 1173 . 1 . 1 270 270 GLN CA C 13 53.51 0.02 . . . . . . . 270 GLN CA . 52655 1 1174 . 1 . 1 270 270 GLN CB C 13 28.77 0.02 . . . . . . . 270 GLN CB . 52655 1 1175 . 1 . 1 270 270 GLN N N 15 122.96 0.04 . . . . . . . 270 GLN N . 52655 1 1176 . 1 . 1 271 271 PRO C C 13 176.52 0.02 . . . . . . . 271 PRO C . 52655 1 1177 . 1 . 1 271 271 PRO CA C 13 62.84 0.02 . . . . . . . 271 PRO CA . 52655 1 1178 . 1 . 1 271 271 PRO CB C 13 31.85 0.02 . . . . . . . 271 PRO CB . 52655 1 1179 . 1 . 1 271 271 PRO N N 15 136.76 0.04 . . . . . . . 271 PRO N . 52655 1 1180 . 1 . 1 272 272 MET H H 1 8.35 0.01 . . . . . . . 272 MET HN . 52655 1 1181 . 1 . 1 272 272 MET C C 13 174.25 0.02 . . . . . . . 272 MET C . 52655 1 1182 . 1 . 1 272 272 MET CA C 13 53.70 0.02 . . . . . . . 272 MET CA . 52655 1 1183 . 1 . 1 272 272 MET CB C 13 29.95 0.02 . . . . . . . 272 MET CB . 52655 1 1184 . 1 . 1 272 272 MET N N 15 122.34 0.04 . . . . . . . 272 MET N . 52655 1 1185 . 1 . 1 273 273 PRO C C 13 177.28 0.02 . . . . . . . 273 PRO C . 52655 1 1186 . 1 . 1 273 273 PRO CA C 13 63.24 0.02 . . . . . . . 273 PRO CA . 52655 1 1187 . 1 . 1 273 273 PRO CB C 13 31.92 0.02 . . . . . . . 273 PRO CB . 52655 1 1188 . 1 . 1 273 273 PRO N N 15 136.85 0.04 . . . . . . . 273 PRO N . 52655 1 1189 . 1 . 1 274 274 GLY H H 1 8.41 0.01 . . . . . . . 274 GLY HN . 52655 1 1190 . 1 . 1 274 274 GLY C C 13 173.70 0.02 . . . . . . . 274 GLY C . 52655 1 1191 . 1 . 1 274 274 GLY CA C 13 44.86 0.02 . . . . . . . 274 GLY CA . 52655 1 1192 . 1 . 1 274 274 GLY N N 15 109.00 0.04 . . . . . . . 274 GLY N . 52655 1 1193 . 1 . 1 275 275 LEU H H 1 7.98 0.01 . . . . . . . 275 LEU HN . 52655 1 1194 . 1 . 1 275 275 LEU C C 13 175.20 0.02 . . . . . . . 275 LEU C . 52655 1 1195 . 1 . 1 275 275 LEU CA C 13 52.87 0.02 . . . . . . . 275 LEU CA . 52655 1 1196 . 1 . 1 275 275 LEU CB C 13 41.65 0.02 . . . . . . . 275 LEU CB . 52655 1 1197 . 1 . 1 275 275 LEU N N 15 122.84 0.04 . . . . . . . 275 LEU N . 52655 1 1198 . 1 . 1 276 276 PRO C C 13 176.52 0.02 . . . . . . . 276 PRO C . 52655 1 1199 . 1 . 1 276 276 PRO CA C 13 62.86 0.02 . . . . . . . 276 PRO CA . 52655 1 1200 . 1 . 1 276 276 PRO CB C 13 31.90 0.02 . . . . . . . 276 PRO CB . 52655 1 1201 . 1 . 1 276 276 PRO N N 15 136.28 0.04 . . . . . . . 276 PRO N . 52655 1 1202 . 1 . 1 277 277 ARG H H 1 8.42 0.01 . . . . . . . 277 ARG HN . 52655 1 1203 . 1 . 1 277 277 ARG C C 13 174.23 0.02 . . . . . . . 277 ARG C . 52655 1 1204 . 1 . 1 277 277 ARG CA C 13 53.30 0.02 . . . . . . . 277 ARG CA . 52655 1 1205 . 1 . 1 277 277 ARG CB C 13 29.25 0.02 . . . . . . . 277 ARG CB . 52655 1 1206 . 1 . 1 277 277 ARG N N 15 121.92 0.04 . . . . . . . 277 ARG N . 52655 1 1207 . 1 . 1 278 278 PRO C C 13 176.63 0.02 . . . . . . . 278 PRO C . 52655 1 1208 . 1 . 1 278 278 PRO CA C 13 62.91 0.02 . . . . . . . 278 PRO CA . 52655 1 1209 . 1 . 1 278 278 PRO CB C 13 32.05 0.02 . . . . . . . 278 PRO CB . 52655 1 1210 . 1 . 1 278 278 PRO N N 15 136.91 0.04 . . . . . . . 278 PRO N . 52655 1 1211 . 1 . 1 279 279 VAL H H 1 8.27 0.01 . . . . . . . 279 VAL HN . 52655 1 1212 . 1 . 1 279 279 VAL C C 13 176.27 0.02 . . . . . . . 279 VAL C . 52655 1 1213 . 1 . 1 279 279 VAL CA C 13 62.46 0.02 . . . . . . . 279 VAL CA . 52655 1 1214 . 1 . 1 279 279 VAL CB C 13 32.44 0.02 . . . . . . . 279 VAL CB . 52655 1 1215 . 1 . 1 279 279 VAL N N 15 121.15 0.04 . . . . . . . 279 VAL N . 52655 1 1216 . 1 . 1 280 280 ILE H H 1 8.22 0.01 . . . . . . . 280 ILE HN . 52655 1 1217 . 1 . 1 280 280 ILE C C 13 176.02 0.02 . . . . . . . 280 ILE C . 52655 1 1218 . 1 . 1 280 280 ILE CA C 13 60.65 0.02 . . . . . . . 280 ILE CA . 52655 1 1219 . 1 . 1 280 280 ILE CB C 13 38.45 0.02 . . . . . . . 280 ILE CB . 52655 1 1220 . 1 . 1 280 280 ILE N N 15 124.96 0.04 . . . . . . . 280 ILE N . 52655 1 1221 . 1 . 1 281 281 SER H H 1 8.36 0.01 . . . . . . . 281 SER HN . 52655 1 1222 . 1 . 1 281 281 SER C C 13 174.55 0.02 . . . . . . . 281 SER C . 52655 1 1223 . 1 . 1 281 281 SER CA C 13 57.88 0.02 . . . . . . . 281 SER CA . 52655 1 1224 . 1 . 1 281 281 SER CB C 13 63.69 0.02 . . . . . . . 281 SER CB . 52655 1 1225 . 1 . 1 281 281 SER N N 15 120.03 0.04 . . . . . . . 281 SER N . 52655 1 1226 . 1 . 1 282 282 MET H H 1 8.47 0.01 . . . . . . . 282 MET HN . 52655 1 1227 . 1 . 1 282 282 MET C C 13 176.36 0.02 . . . . . . . 282 MET C . 52655 1 1228 . 1 . 1 282 282 MET CA C 13 55.59 0.02 . . . . . . . 282 MET CA . 52655 1 1229 . 1 . 1 282 282 MET CB C 13 32.45 0.02 . . . . . . . 282 MET CB . 52655 1 1230 . 1 . 1 282 282 MET N N 15 122.89 0.04 . . . . . . . 282 MET N . 52655 1 1231 . 1 . 1 283 283 GLN H H 1 8.34 0.01 . . . . . . . 283 GLN HN . 52655 1 1232 . 1 . 1 283 283 GLN C C 13 175.86 0.02 . . . . . . . 283 GLN C . 52655 1 1233 . 1 . 1 283 283 GLN CA C 13 55.93 0.02 . . . . . . . 283 GLN CA . 52655 1 1234 . 1 . 1 283 283 GLN CB C 13 29.14 0.02 . . . . . . . 283 GLN CB . 52655 1 1235 . 1 . 1 283 283 GLN N N 15 121.17 0.04 . . . . . . . 283 GLN N . 52655 1 1236 . 1 . 1 284 284 ALA H H 1 8.30 0.01 . . . . . . . 284 ALA HN . 52655 1 1237 . 1 . 1 284 284 ALA C C 13 177.82 0.02 . . . . . . . 284 ALA C . 52655 1 1238 . 1 . 1 284 284 ALA CA C 13 52.64 0.02 . . . . . . . 284 ALA CA . 52655 1 1239 . 1 . 1 284 284 ALA CB C 13 18.88 0.02 . . . . . . . 284 ALA CB . 52655 1 1240 . 1 . 1 284 284 ALA N N 15 125.22 0.04 . . . . . . . 284 ALA N . 52655 1 1241 . 1 . 1 285 285 GLN H H 1 8.29 0.01 . . . . . . . 285 GLN HN . 52655 1 1242 . 1 . 1 285 285 GLN C C 13 175.79 0.02 . . . . . . . 285 GLN C . 52655 1 1243 . 1 . 1 285 285 GLN CA C 13 55.72 0.02 . . . . . . . 285 GLN CA . 52655 1 1244 . 1 . 1 285 285 GLN CB C 13 29.34 0.02 . . . . . . . 285 GLN CB . 52655 1 1245 . 1 . 1 285 285 GLN N N 15 119.42 0.04 . . . . . . . 285 GLN N . 52655 1 1246 . 1 . 1 286 286 ALA H H 1 8.23 0.01 . . . . . . . 286 ALA HN . 52655 1 1247 . 1 . 1 286 286 ALA C C 13 177.40 0.02 . . . . . . . 286 ALA C . 52655 1 1248 . 1 . 1 286 286 ALA CA C 13 52.30 0.02 . . . . . . . 286 ALA CA . 52655 1 1249 . 1 . 1 286 286 ALA CB C 13 18.97 0.02 . . . . . . . 286 ALA CB . 52655 1 1250 . 1 . 1 286 286 ALA N N 15 125.00 0.04 . . . . . . . 286 ALA N . 52655 1 1251 . 1 . 1 287 287 ALA H H 1 8.19 0.01 . . . . . . . 287 ALA HN . 52655 1 1252 . 1 . 1 287 287 ALA C C 13 177.68 0.02 . . . . . . . 287 ALA C . 52655 1 1253 . 1 . 1 287 287 ALA CA C 13 52.32 0.02 . . . . . . . 287 ALA CA . 52655 1 1254 . 1 . 1 287 287 ALA CB C 13 18.95 0.02 . . . . . . . 287 ALA CB . 52655 1 1255 . 1 . 1 287 287 ALA N N 15 123.15 0.04 . . . . . . . 287 ALA N . 52655 1 1256 . 1 . 1 288 288 VAL H H 1 8.00 0.01 . . . . . . . 288 VAL HN . 52655 1 1257 . 1 . 1 288 288 VAL C C 13 175.73 0.02 . . . . . . . 288 VAL C . 52655 1 1258 . 1 . 1 288 288 VAL CA C 13 61.95 0.02 . . . . . . . 288 VAL CA . 52655 1 1259 . 1 . 1 288 288 VAL CB C 13 32.76 0.02 . . . . . . . 288 VAL CB . 52655 1 1260 . 1 . 1 288 288 VAL N N 15 119.04 0.04 . . . . . . . 288 VAL N . 52655 1 1261 . 1 . 1 289 289 ALA H H 1 8.33 0.01 . . . . . . . 289 ALA HN . 52655 1 1262 . 1 . 1 289 289 ALA C C 13 177.63 0.02 . . . . . . . 289 ALA C . 52655 1 1263 . 1 . 1 289 289 ALA CA C 13 52.17 0.02 . . . . . . . 289 ALA CA . 52655 1 1264 . 1 . 1 289 289 ALA CB C 13 19.38 0.02 . . . . . . . 289 ALA CB . 52655 1 1265 . 1 . 1 289 289 ALA N N 15 127.76 0.04 . . . . . . . 289 ALA N . 52655 1 1266 . 1 . 1 290 290 GLY H H 1 8.15 0.01 . . . . . . . 290 GLY HN . 52655 1 1267 . 1 . 1 290 290 GLY C C 13 171.60 0.02 . . . . . . . 290 GLY C . 52655 1 1268 . 1 . 1 290 290 GLY CA C 13 44.38 0.02 . . . . . . . 290 GLY CA . 52655 1 1269 . 1 . 1 290 290 GLY N N 15 108.51 0.04 . . . . . . . 290 GLY N . 52655 1 1270 . 1 . 1 291 291 PRO C C 13 176.89 0.02 . . . . . . . 291 PRO C . 52655 1 1271 . 1 . 1 291 291 PRO CA C 13 62.88 0.02 . . . . . . . 291 PRO CA . 52655 1 1272 . 1 . 1 291 291 PRO CB C 13 32.03 0.02 . . . . . . . 291 PRO CB . 52655 1 1273 . 1 . 1 291 291 PRO N N 15 134.27 0.04 . . . . . . . 291 PRO N . 52655 1 1274 . 1 . 1 292 292 ARG H H 1 8.43 0.01 . . . . . . . 292 ARG HN . 52655 1 1275 . 1 . 1 292 292 ARG C C 13 176.13 0.02 . . . . . . . 292 ARG C . 52655 1 1276 . 1 . 1 292 292 ARG CA C 13 55.72 0.02 . . . . . . . 292 ARG CA . 52655 1 1277 . 1 . 1 292 292 ARG CB C 13 30.55 0.02 . . . . . . . 292 ARG CB . 52655 1 1278 . 1 . 1 292 292 ARG N N 15 121.17 0.04 . . . . . . . 292 ARG N . 52655 1 1279 . 1 . 1 293 293 MET H H 1 8.40 0.01 . . . . . . . 293 MET HN . 52655 1 1280 . 1 . 1 293 293 MET C C 13 174.17 0.02 . . . . . . . 293 MET C . 52655 1 1281 . 1 . 1 293 293 MET CA C 13 52.93 0.02 . . . . . . . 293 MET CA . 52655 1 1282 . 1 . 1 293 293 MET CB C 13 32.16 0.02 . . . . . . . 293 MET CB . 52655 1 1283 . 1 . 1 293 293 MET N N 15 123.22 0.04 . . . . . . . 293 MET N . 52655 1 1284 . 1 . 1 294 294 PRO C C 13 176.71 0.02 . . . . . . . 294 PRO C . 52655 1 1285 . 1 . 1 294 294 PRO CA C 13 63.08 0.02 . . . . . . . 294 PRO CA . 52655 1 1286 . 1 . 1 294 294 PRO CB C 13 32.05 0.02 . . . . . . . 294 PRO CB . 52655 1 1287 . 1 . 1 294 294 PRO N N 15 136.85 0.04 . . . . . . . 294 PRO N . 52655 1 1288 . 1 . 1 295 295 SER H H 1 8.39 0.01 . . . . . . . 295 SER HN . 52655 1 1289 . 1 . 1 295 295 SER C C 13 174.77 0.02 . . . . . . . 295 SER C . 52655 1 1290 . 1 . 1 295 295 SER CA C 13 58.03 0.02 . . . . . . . 295 SER CA . 52655 1 1291 . 1 . 1 295 295 SER CB C 13 63.72 0.02 . . . . . . . 295 SER CB . 52655 1 1292 . 1 . 1 295 295 SER N N 15 116.22 0.04 . . . . . . . 295 SER N . 52655 1 1293 . 1 . 1 296 296 VAL H H 1 8.19 0.01 . . . . . . . 296 VAL HN . 52655 1 1294 . 1 . 1 296 296 VAL C C 13 176.36 0.02 . . . . . . . 296 VAL C . 52655 1 1295 . 1 . 1 296 296 VAL CA C 13 62.58 0.02 . . . . . . . 296 VAL CA . 52655 1 1296 . 1 . 1 296 296 VAL CB C 13 32.37 0.02 . . . . . . . 296 VAL CB . 52655 1 1297 . 1 . 1 296 296 VAL N N 15 121.49 0.04 . . . . . . . 296 VAL N . 52655 1 1298 . 1 . 1 297 297 GLN H H 1 8.37 0.01 . . . . . . . 297 GLN HN . 52655 1 1299 . 1 . 1 297 297 GLN C C 13 176.13 0.02 . . . . . . . 297 GLN C . 52655 1 1300 . 1 . 1 297 297 GLN CA C 13 56.15 0.02 . . . . . . . 297 GLN CA . 52655 1 1301 . 1 . 1 297 297 GLN CB C 13 29.13 0.02 . . . . . . . 297 GLN CB . 52655 1 1302 . 1 . 1 297 297 GLN N N 15 123.17 0.04 . . . . . . . 297 GLN N . 52655 1 stop_ save_